forked from IPKM/nmreval
more interactive edit
This commit is contained in:
parent
6339bdc2cc
commit
7fe564a61e
@ -14,54 +14,167 @@ from PyQt5 import QtCore, QtGui, QtWidgets
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class Ui_ApodEdit(object):
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class Ui_ApodEdit(object):
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def setupUi(self, ApodEdit):
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def setupUi(self, ApodEdit):
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ApodEdit.setObjectName("ApodEdit")
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ApodEdit.setObjectName("ApodEdit")
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ApodEdit.resize(784, 484)
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ApodEdit.resize(1144, 655)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Preferred, QtWidgets.QSizePolicy.Preferred)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Preferred, QtWidgets.QSizePolicy.Preferred)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(ApodEdit.sizePolicy().hasHeightForWidth())
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sizePolicy.setHeightForWidth(ApodEdit.sizePolicy().hasHeightForWidth())
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ApodEdit.setSizePolicy(sizePolicy)
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ApodEdit.setSizePolicy(sizePolicy)
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self.gridLayout = QtWidgets.QGridLayout(ApodEdit)
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self.gridLayout = QtWidgets.QGridLayout(ApodEdit)
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self.gridLayout.setContentsMargins(3, 3, 3, 3)
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self.gridLayout.setContentsMargins(9, 9, 9, 9)
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self.gridLayout.setSpacing(3)
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self.gridLayout.setSpacing(3)
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self.gridLayout.setObjectName("gridLayout")
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self.gridLayout.setObjectName("gridLayout")
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self.graphicsView = NMRPlotWidget(ApodEdit)
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self.time_graph = NMRPlotWidget(ApodEdit)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.MinimumExpanding, QtWidgets.QSizePolicy.Expanding)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.MinimumExpanding, QtWidgets.QSizePolicy.Expanding)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(self.graphicsView.sizePolicy().hasHeightForWidth())
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sizePolicy.setHeightForWidth(self.time_graph.sizePolicy().hasHeightForWidth())
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self.graphicsView.setSizePolicy(sizePolicy)
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self.time_graph.setSizePolicy(sizePolicy)
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self.graphicsView.setObjectName("graphicsView")
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self.time_graph.setObjectName("time_graph")
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self.gridLayout.addWidget(self.graphicsView, 2, 0, 1, 1)
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self.gridLayout.addWidget(self.time_graph, 2, 1, 1, 1)
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self.graphicsView_2 = NMRPlotWidget(ApodEdit)
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self.freq_graph = NMRPlotWidget(ApodEdit)
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self.graphicsView_2.setObjectName("graphicsView_2")
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self.freq_graph.setObjectName("freq_graph")
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self.gridLayout.addWidget(self.graphicsView_2, 2, 1, 1, 1)
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self.gridLayout.addWidget(self.freq_graph, 2, 2, 1, 1)
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self.apodcombobox = QtWidgets.QComboBox(ApodEdit)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.MinimumExpanding, QtWidgets.QSizePolicy.Fixed)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(self.apodcombobox.sizePolicy().hasHeightForWidth())
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self.apodcombobox.setSizePolicy(sizePolicy)
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self.apodcombobox.setObjectName("apodcombobox")
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self.gridLayout.addWidget(self.apodcombobox, 0, 0, 1, 1)
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self.widget_layout = QtWidgets.QHBoxLayout()
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self.widget_layout.setContentsMargins(-1, 6, -1, -1)
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self.widget_layout.setSpacing(20)
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self.widget_layout.setObjectName("widget_layout")
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self.gridLayout.addLayout(self.widget_layout, 1, 0, 1, 2)
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self.buttonBox = QtWidgets.QDialogButtonBox(ApodEdit)
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self.buttonBox = QtWidgets.QDialogButtonBox(ApodEdit)
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self.buttonBox.setOrientation(QtCore.Qt.Horizontal)
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self.buttonBox.setOrientation(QtCore.Qt.Horizontal)
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self.buttonBox.setStandardButtons(QtWidgets.QDialogButtonBox.Cancel|QtWidgets.QDialogButtonBox.Ok)
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self.buttonBox.setStandardButtons(QtWidgets.QDialogButtonBox.Cancel|QtWidgets.QDialogButtonBox.Ok)
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self.buttonBox.setObjectName("buttonBox")
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self.buttonBox.setObjectName("buttonBox")
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self.gridLayout.addWidget(self.buttonBox, 4, 0, 1, 2)
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self.gridLayout.addWidget(self.buttonBox, 4, 1, 1, 2)
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self.eqn_label = QtWidgets.QLabel(ApodEdit)
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self.widget = QtWidgets.QWidget(ApodEdit)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.MinimumExpanding, QtWidgets.QSizePolicy.Preferred)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Maximum, QtWidgets.QSizePolicy.Preferred)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(self.eqn_label.sizePolicy().hasHeightForWidth())
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sizePolicy.setHeightForWidth(self.widget.sizePolicy().hasHeightForWidth())
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self.eqn_label.setSizePolicy(sizePolicy)
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self.widget.setSizePolicy(sizePolicy)
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self.widget.setObjectName("widget")
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self.verticalLayout = QtWidgets.QVBoxLayout(self.widget)
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self.verticalLayout.setObjectName("verticalLayout")
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self.baseline_box = QtWidgets.QCheckBox(self.widget)
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self.baseline_box.setObjectName("baseline_box")
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self.verticalLayout.addWidget(self.baseline_box)
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self.shift_box = QtWidgets.QGroupBox(self.widget)
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self.shift_box.setFlat(True)
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self.shift_box.setCheckable(True)
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self.shift_box.setChecked(False)
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self.shift_box.setObjectName("shift_box")
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self.gridLayout_4 = QtWidgets.QGridLayout(self.shift_box)
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self.gridLayout_4.setContentsMargins(3, 3, 3, 3)
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self.gridLayout_4.setSpacing(3)
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self.gridLayout_4.setObjectName("gridLayout_4")
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self.ls_lineedit = QtWidgets.QLineEdit(self.shift_box)
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self.ls_lineedit.setObjectName("ls_lineedit")
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self.gridLayout_4.addWidget(self.ls_lineedit, 1, 1, 1, 1)
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self.ls_spinbox = QtWidgets.QSpinBox(self.shift_box)
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self.ls_spinbox.setMaximum(999999)
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self.ls_spinbox.setObjectName("ls_spinbox")
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self.gridLayout_4.addWidget(self.ls_spinbox, 0, 1, 1, 1)
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self.ls_combobox = QtWidgets.QComboBox(self.shift_box)
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self.ls_combobox.setObjectName("ls_combobox")
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self.ls_combobox.addItem("")
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self.ls_combobox.addItem("")
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self.gridLayout_4.addWidget(self.ls_combobox, 0, 0, 2, 1)
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self.verticalLayout.addWidget(self.shift_box)
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self.apod_box = QtWidgets.QGroupBox(self.widget)
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self.apod_box.setFlat(True)
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self.apod_box.setCheckable(True)
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self.apod_box.setChecked(False)
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self.apod_box.setObjectName("apod_box")
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self.verticalLayout_2 = QtWidgets.QVBoxLayout(self.apod_box)
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self.verticalLayout_2.setContentsMargins(3, 3, 3, 3)
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self.verticalLayout_2.setSpacing(3)
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self.verticalLayout_2.setObjectName("verticalLayout_2")
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self.apodcombobox = QtWidgets.QComboBox(self.apod_box)
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self.apodcombobox.setObjectName("apodcombobox")
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self.verticalLayout_2.addWidget(self.apodcombobox)
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self.eqn_label = QtWidgets.QLabel(self.apod_box)
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self.eqn_label.setIndent(3)
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self.eqn_label.setIndent(3)
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self.eqn_label.setObjectName("eqn_label")
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self.eqn_label.setObjectName("eqn_label")
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self.gridLayout.addWidget(self.eqn_label, 0, 1, 1, 1)
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self.verticalLayout_2.addWidget(self.eqn_label)
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self.widget_layout = QtWidgets.QHBoxLayout()
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self.widget_layout.setContentsMargins(-1, 6, -1, -1)
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self.widget_layout.setSpacing(20)
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self.widget_layout.setObjectName("widget_layout")
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self.verticalLayout_2.addLayout(self.widget_layout)
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self.verticalLayout.addWidget(self.apod_box)
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self.zerofill_box = QtWidgets.QGroupBox(self.widget)
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self.zerofill_box.setFlat(True)
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self.zerofill_box.setCheckable(True)
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self.zerofill_box.setChecked(False)
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self.zerofill_box.setObjectName("zerofill_box")
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self.horizontalLayout = QtWidgets.QHBoxLayout(self.zerofill_box)
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self.horizontalLayout.setContentsMargins(3, 3, 3, 3)
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self.horizontalLayout.setSpacing(3)
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self.horizontalLayout.setObjectName("horizontalLayout")
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self.label = QtWidgets.QLabel(self.zerofill_box)
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self.label.setObjectName("label")
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self.horizontalLayout.addWidget(self.label)
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self.zf_spinbox = QtWidgets.QSpinBox(self.zerofill_box)
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self.zf_spinbox.setMinimum(1)
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self.zf_spinbox.setMaximum(3)
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self.zf_spinbox.setObjectName("zf_spinbox")
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self.horizontalLayout.addWidget(self.zf_spinbox)
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self.verticalLayout.addWidget(self.zerofill_box)
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self.phase_box = QtWidgets.QGroupBox(self.widget)
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self.phase_box.setFlat(True)
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self.phase_box.setCheckable(True)
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self.phase_box.setChecked(False)
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self.phase_box.setObjectName("phase_box")
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self.gridLayout_2 = QtWidgets.QGridLayout(self.phase_box)
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self.gridLayout_2.setContentsMargins(3, 3, 3, 3)
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self.gridLayout_2.setSpacing(3)
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self.gridLayout_2.setObjectName("gridLayout_2")
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self.label_3 = QtWidgets.QLabel(self.phase_box)
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self.label_3.setObjectName("label_3")
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self.gridLayout_2.addWidget(self.label_3, 1, 0, 1, 1)
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self.label_4 = QtWidgets.QLabel(self.phase_box)
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self.label_4.setObjectName("label_4")
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self.gridLayout_2.addWidget(self.label_4, 2, 0, 1, 1)
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self.ph0_spinbox = QtWidgets.QDoubleSpinBox(self.phase_box)
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self.ph0_spinbox.setWrapping(True)
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self.ph0_spinbox.setDecimals(1)
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self.ph0_spinbox.setMinimum(-180.0)
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self.ph0_spinbox.setMaximum(180.0)
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self.ph0_spinbox.setSingleStep(0.5)
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self.ph0_spinbox.setObjectName("ph0_spinbox")
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self.gridLayout_2.addWidget(self.ph0_spinbox, 0, 1, 1, 1)
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self.pivot_lineedit = QtWidgets.QLineEdit(self.phase_box)
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self.pivot_lineedit.setObjectName("pivot_lineedit")
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self.gridLayout_2.addWidget(self.pivot_lineedit, 2, 1, 1, 1)
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self.label_2 = QtWidgets.QLabel(self.phase_box)
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self.label_2.setObjectName("label_2")
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self.gridLayout_2.addWidget(self.label_2, 0, 0, 1, 1)
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self.ph1_spinbox = QtWidgets.QDoubleSpinBox(self.phase_box)
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self.ph1_spinbox.setWrapping(True)
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self.ph1_spinbox.setDecimals(2)
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self.ph1_spinbox.setMinimum(-720.0)
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self.ph1_spinbox.setMaximum(720.0)
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self.ph1_spinbox.setSingleStep(0.05)
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self.ph1_spinbox.setObjectName("ph1_spinbox")
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self.gridLayout_2.addWidget(self.ph1_spinbox, 1, 1, 1, 1)
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self.verticalLayout.addWidget(self.phase_box)
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self.ft_box = QtWidgets.QGroupBox(self.widget)
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self.ft_box.setCheckable(True)
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self.ft_box.setChecked(False)
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self.ft_box.setObjectName("ft_box")
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self.verticalLayout_3 = QtWidgets.QVBoxLayout(self.ft_box)
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self.verticalLayout_3.setContentsMargins(3, 3, 3, 3)
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self.verticalLayout_3.setSpacing(3)
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self.verticalLayout_3.setObjectName("verticalLayout_3")
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self.phase_before_button = QtWidgets.QRadioButton(self.ft_box)
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self.phase_before_button.setChecked(True)
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self.phase_before_button.setObjectName("phase_before_button")
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self.buttonGroup = QtWidgets.QButtonGroup(ApodEdit)
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self.buttonGroup.setObjectName("buttonGroup")
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self.buttonGroup.addButton(self.phase_before_button)
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self.verticalLayout_3.addWidget(self.phase_before_button)
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self.phase_after_button = QtWidgets.QRadioButton(self.ft_box)
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self.phase_after_button.setObjectName("phase_after_button")
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self.buttonGroup.addButton(self.phase_after_button)
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self.verticalLayout_3.addWidget(self.phase_after_button)
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self.verticalLayout.addWidget(self.ft_box)
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spacerItem = QtWidgets.QSpacerItem(20, 40, QtWidgets.QSizePolicy.Minimum, QtWidgets.QSizePolicy.Expanding)
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self.verticalLayout.addItem(spacerItem)
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self.gridLayout.addWidget(self.widget, 2, 0, 1, 1)
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self.retranslateUi(ApodEdit)
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self.retranslateUi(ApodEdit)
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self.buttonBox.accepted.connect(ApodEdit.accept) # type: ignore
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self.buttonBox.accepted.connect(ApodEdit.accept) # type: ignore
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@ -71,5 +184,22 @@ class Ui_ApodEdit(object):
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def retranslateUi(self, ApodEdit):
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def retranslateUi(self, ApodEdit):
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_translate = QtCore.QCoreApplication.translate
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_translate = QtCore.QCoreApplication.translate
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ApodEdit.setWindowTitle(_translate("ApodEdit", "Apodization"))
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ApodEdit.setWindowTitle(_translate("ApodEdit", "Apodization"))
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self.baseline_box.setText(_translate("ApodEdit", "Baseline"))
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self.shift_box.setTitle(_translate("ApodEdit", "Shift"))
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self.ls_lineedit.setText(_translate("ApodEdit", "0"))
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self.ls_combobox.setItemText(0, _translate("ApodEdit", "Points"))
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self.ls_combobox.setItemText(1, _translate("ApodEdit", "Seconds"))
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self.apod_box.setTitle(_translate("ApodEdit", "Apodization"))
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self.eqn_label.setText(_translate("ApodEdit", "TextLabel"))
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self.eqn_label.setText(_translate("ApodEdit", "TextLabel"))
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self.zerofill_box.setTitle(_translate("ApodEdit", "Zero fill"))
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self.label.setText(_translate("ApodEdit", "Double length"))
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self.zf_spinbox.setSuffix(_translate("ApodEdit", "x"))
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self.phase_box.setTitle(_translate("ApodEdit", "Phase correction"))
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self.label_3.setText(_translate("ApodEdit", "Phase 1"))
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self.label_4.setText(_translate("ApodEdit", "Pivot"))
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self.pivot_lineedit.setText(_translate("ApodEdit", "0"))
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self.label_2.setText(_translate("ApodEdit", "Phase 0"))
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self.ft_box.setTitle(_translate("ApodEdit", "Fourier transform"))
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self.phase_before_button.setText(_translate("ApodEdit", "before phase correction"))
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self.phase_after_button.setText(_translate("ApodEdit", "after phase correction"))
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from ..lib.graph_items import NMRPlotWidget
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from ..lib.graph_items import NMRPlotWidget
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@ -749,3 +749,41 @@ class SignalContainer(ExperimentContainer):
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self._update_actions()
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self._update_actions()
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return self
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return self
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@plot_update
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def edit_signal(
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self: SignalContainer,
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baseline: tuple[None | bool],
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leftshift: tuple[None | float, str],
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zerofill: tuple[None, int],
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apod: tuple[None, list[float], type[object]],
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phase: tuple[None | float, float, float],
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fourier: tuple[None | bool]
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):
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"""
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Function for EditUndoCommand to call if a timesignal or spectra must be worked on.
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This avoids to update the plot for every action we do and makes it slightly faster.
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"""
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if baseline[0] is not None:
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self._data.baseline()
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if leftshift[0] is not None:
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self._data.shift(*leftshift)
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if zerofill[0] is not None:
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self._data.zerofill(*zerofill)
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if apod[0] is not None:
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self._data.apod(*apod)
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if fourier[0] is not None:
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print(fourier)
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if fourier[0]:
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if phase[0] is not None:
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self._data.manual_phase(*phase)
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self.fourier()
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else:
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self.fourier()
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if phase[0] is not None:
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self._data.manual_phase(*phase)
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@ -1,2 +1,2 @@
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from .phase_dialog import QApodDialog, QPhasedialog
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from .phase_dialog import QPreviewDialog
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from .baseline_dialog import QBaselineDialog
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from .baseline_dialog import QBaselineDialog
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@ -1,119 +1,43 @@
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from __future__ import annotations
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from __future__ import annotations
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import numpy as np
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from pyqtgraph import mkPen
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from pyqtgraph import mkPen
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from numpy import inf, linspace
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import numpy as np
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from numpy.fft import fft, fftfreq, fftshift
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from numpy import pi
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from numpy.fft import fft, fftshift, fftfreq
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from nmreval.data import FID, Spectrum
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from ...lib.pg_objects import PlotItem, LogInfiniteLine
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from ...lib.pg_objects import PlotItem, LogInfiniteLine
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from nmreval.lib.importer import find_models
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from nmreval.lib.importer import find_models
|
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from nmreval.math import apodization as apodization
|
from nmreval.math import apodization as apodization
|
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from nmreval.utils.text import convert
|
from nmreval.utils.text import convert
|
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|
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from ...Qt import QtCore, QtWidgets
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from ...Qt import QtCore, QtWidgets, QtGui
|
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from ..._py.apod_dialog import Ui_ApodEdit
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from ..._py.apod_dialog import Ui_ApodEdit
|
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from ..._py.phase_corr_dialog import Ui_SignalEdit
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|
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from ...lib.forms import FormWidget
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from ...lib.forms import FormWidget
|
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|
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|
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class QPreviewDialogs(QtWidgets.QDialog):
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class QPreviewDialog(QtWidgets.QDialog, Ui_ApodEdit):
|
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finished = QtCore.pyqtSignal(str, tuple)
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finished = QtCore.pyqtSignal(str, tuple)
|
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|
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def __init__(self, parent=None):
|
def __init__(self, parent=None):
|
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super().__init__(parent=parent)
|
super().__init__(parent=parent)
|
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|
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self.data = []
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self.graphs = []
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|
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self.mode = ''
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|
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def setRange(self, xlim: list, ylim: list, logmode: list[bool]):
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|
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self.graphicsView.getPlotItem().setLogMode(x=logmode[0], y=logmode[1])
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|
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if logmode[0]:
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|
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xlim = [np.log10(x) for x in xlim]
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|
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if logmode[1]:
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|
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ylim = [np.log10(y) for y in ylim]
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|
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|
||||||
self.graphicsView.setRange(xRange=xlim, yRange=ylim, padding=0, disableAutoRange=True)
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|
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|
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def add_data(self, x, y):
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|
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self.data.append((x, y))
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|
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real_plt = PlotItem(x=x, y=y.real, pen=mkPen('b'), )
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|
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imag_plt = PlotItem(x=x, y=y.imag, pen=mkPen('r'))
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|
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self.graphs.append((real_plt, imag_plt))
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|
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self.graphicsView.addItem(real_plt)
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|
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self.graphicsView.addItem(imag_plt)
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|
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|
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def done(self, val):
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|
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self.cleanup()
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|
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super().done(val)
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|
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|
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def close(self):
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|
||||||
self.cleanup()
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|
||||||
super().close()
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|
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|
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def accept(self):
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|
||||||
self.finished.emit(self.mode, self.get_value())
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|
||||||
super().accept()
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|
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|
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def get_value(self):
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|
||||||
raise NotImplementedError
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|
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|
||||||
def cleanup(self):
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|
||||||
self.blockSignals(True)
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|
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|
||||||
for line in self.graphs:
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|
||||||
for g in line:
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|
||||||
self.graphicsView.removeItem(g)
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|
||||||
del g
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|
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|
||||||
self.graphicsView.clear()
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|
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|
||||||
self.data = []
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|
||||||
self.graphs = []
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|
||||||
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|
||||||
self.blockSignals(False)
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|
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|
||||||
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|
||||||
class QPhasedialog(QPreviewDialogs, Ui_SignalEdit):
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|
||||||
def __init__(self, parent=None):
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|
||||||
super().__init__(parent=parent)
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|
||||||
self.setupUi(self)
|
self.setupUi(self)
|
||||||
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|
||||||
self.mode = 'ph'
|
self.data = []
|
||||||
|
self.graphs = []
|
||||||
|
self._tmp_data_bl = []
|
||||||
|
self._tmp_data_zf = []
|
||||||
|
self._tmp_data_ls = []
|
||||||
|
self._tmp_data_ap = []
|
||||||
|
self._tmp_data_ph = []
|
||||||
|
|
||||||
self.pvt_line = LogInfiniteLine(pos=0, movable=True)
|
self.pvt_line = LogInfiniteLine(pos=0, movable=True)
|
||||||
self.graphicsView.addItem(self.pvt_line)
|
self.freq_graph.addItem(self.pvt_line)
|
||||||
self.pvt_line.sigPositionChanged.connect(self.move_line)
|
self.pvt_line.sigPositionChanged.connect(self.move_line)
|
||||||
|
|
||||||
@QtCore.pyqtSlot(float, name='on_ph1slider_valueChanged')
|
self.ls_lineedit.hide()
|
||||||
@QtCore.pyqtSlot(float, name='on_ph0slider_valueChanged')
|
|
||||||
def _temp_phase(self, *args):
|
|
||||||
ph0, ph1, pvt = self.get_value()
|
|
||||||
self.pvt_line.setValue(pvt)
|
|
||||||
|
|
||||||
for i, (x, y) in enumerate(self.data):
|
|
||||||
phasecorr = np.exp(-1j * (ph0 + ph1*(x-pvt)/np.max(x))*np.pi/180.)
|
|
||||||
_y = y * phasecorr
|
|
||||||
|
|
||||||
self.graphs[i][0].setData(x=x, y=_y.real)
|
|
||||||
self.graphs[i][1].setData(x=x, y=_y.imag)
|
|
||||||
|
|
||||||
def get_value(self):
|
|
||||||
return float(self.ph0slider.text()), float(self.ph1slider.text()), float(self.pivot_lineedit.text())
|
|
||||||
|
|
||||||
def move_line(self, evt):
|
|
||||||
self.pivot_lineedit.setText(f'{evt.value():.5g}')
|
|
||||||
|
|
||||||
|
|
||||||
class QApodDialog(QPreviewDialogs, Ui_ApodEdit):
|
|
||||||
def __init__(self, parent=None):
|
|
||||||
super().__init__(parent=parent)
|
|
||||||
self.setupUi(self)
|
|
||||||
|
|
||||||
self._limits = (-inf, inf), -inf
|
|
||||||
|
|
||||||
self.apods = []
|
|
||||||
self.apods = find_models(apodization)
|
self.apods = find_models(apodization)
|
||||||
|
|
||||||
self.apodcombobox.blockSignals(True)
|
self.apodcombobox.blockSignals(True)
|
||||||
@ -122,72 +46,246 @@ class QApodDialog(QPreviewDialogs, Ui_ApodEdit):
|
|||||||
self.apodcombobox.blockSignals(False)
|
self.apodcombobox.blockSignals(False)
|
||||||
|
|
||||||
self.apod_graph = PlotItem(x=[], y=[])
|
self.apod_graph = PlotItem(x=[], y=[])
|
||||||
self.graphicsView.addItem(self.apod_graph)
|
self.time_graph.addItem(self.apod_graph)
|
||||||
|
|
||||||
self.mode = 'ap'
|
for g in [self.freq_graph, self.time_graph]:
|
||||||
|
pl = g.getPlotItem()
|
||||||
|
pl.hideButtons()
|
||||||
|
pl.setMenuEnabled(False)
|
||||||
|
|
||||||
|
self._all_time = None
|
||||||
|
self._all_freq = None
|
||||||
|
|
||||||
self.change_apodization(0)
|
self.change_apodization(0)
|
||||||
|
|
||||||
def add_data(self, x, y):
|
self.shift_box.clicked.connect(self._update_shift)
|
||||||
real_plt = PlotItem(x=x, y=y.real, pen=mkPen('b'))
|
self.ls_spinbox.valueChanged.connect(self._update_shift)
|
||||||
# imag_plt = (x=x, y=y.imag, pen=pg.mkPen('r'))
|
self.ls_lineedit.setValidator(QtGui.QDoubleValidator())
|
||||||
self.graphicsView.addItem(real_plt)
|
self.ls_lineedit.textChanged.connect(self._update_shift)
|
||||||
# self.graphicsView.addItem(imag_plt)
|
|
||||||
|
|
||||||
|
self.zerofill_box.clicked.connect(self._update_zf)
|
||||||
|
self.zf_spinbox.valueChanged.connect(self._update_zf)
|
||||||
|
|
||||||
|
self.apod_box.clicked.connect(self._update_apod)
|
||||||
|
|
||||||
|
self.phase_box.clicked.connect(self._update_phase)
|
||||||
|
self.ph0_spinbox.valueChanged.connect(self._update_phase)
|
||||||
|
self.ph1_spinbox.valueChanged.connect(self._update_phase)
|
||||||
|
self.pivot_lineedit.setValidator(QtGui.QDoubleValidator())
|
||||||
|
self.pivot_lineedit.textChanged.connect(self._update_phase)
|
||||||
|
self.pivot_lineedit.textEdited.connect(lambda x: self.pvt_line.setValue(float(x)))
|
||||||
|
|
||||||
|
def add_data(self: QPreviewDialog, data: FID | Spectrum) -> bool:
|
||||||
|
|
||||||
|
if isinstance(data, FID):
|
||||||
|
if self._all_freq:
|
||||||
|
msg = QtWidgets.QMessageBox.warning(self, 'Mixed types',
|
||||||
|
'Timesignals and spectra cannot be edited at the same time.')
|
||||||
|
return False
|
||||||
|
else:
|
||||||
|
self._all_time = True
|
||||||
|
self._all_freq = False
|
||||||
|
|
||||||
|
elif isinstance(data, Spectrum):
|
||||||
|
if self._all_time:
|
||||||
|
msg = QtWidgets.QMessageBox.warning(self, 'Mixed types',
|
||||||
|
'Timesignals and spectra cannot be edited at the same time.')
|
||||||
|
return False
|
||||||
|
else:
|
||||||
|
self._all_time = False
|
||||||
|
self._all_freq = True
|
||||||
|
|
||||||
|
fid = data.copy()
|
||||||
|
spec = self._temp_fft(fid.x, fid.y)
|
||||||
|
|
||||||
|
x_len = data.x.size
|
||||||
|
self.zf_spinbox.setMaximum(min(2**17//x_len, 3))
|
||||||
|
|
||||||
|
real_plt = PlotItem(x=fid.x, y=fid.y.real, pen=mkPen('b'))
|
||||||
|
imag_plt = PlotItem(x=fid.x, y=fid.y.imag, pen=mkPen('r'))
|
||||||
|
self.time_graph.addItem(imag_plt)
|
||||||
|
self.time_graph.addItem(real_plt)
|
||||||
|
|
||||||
|
real_plt_fft = PlotItem(x=spec[0], y=spec[1].real, pen=mkPen('b'))
|
||||||
|
imag_plt_fft = PlotItem(x=spec[0], y=spec[1].imag, pen=mkPen('r'))
|
||||||
|
self.freq_graph.addItem(imag_plt_fft)
|
||||||
|
self.freq_graph.addItem(real_plt_fft)
|
||||||
|
|
||||||
|
self.data.append(data)
|
||||||
|
for p in [self._tmp_data_bl, self._tmp_data_ls]:
|
||||||
|
p.append(data.y.copy())
|
||||||
|
|
||||||
|
for p in [self._tmp_data_zf, self._tmp_data_ap]:
|
||||||
|
p.append((data.x, data.y.copy()))
|
||||||
|
|
||||||
|
self._tmp_data_ph.append((data.x, data.y, spec[0], spec[1]))
|
||||||
|
|
||||||
|
self.graphs.append((real_plt, imag_plt, real_plt_fft, imag_plt_fft))
|
||||||
|
|
||||||
|
return True
|
||||||
|
|
||||||
|
@QtCore.pyqtSlot(name='on_baseline_box_clicked')
|
||||||
|
def _update_bl(self):
|
||||||
|
if self.baseline_box.isChecked():
|
||||||
|
for y in self._tmp_data_bl:
|
||||||
|
y -= y[int(-0.12*y.size):].mean()
|
||||||
|
else:
|
||||||
|
for i, d in enumerate(self.data):
|
||||||
|
self._tmp_data_bl[i] = d.y.copy()
|
||||||
|
|
||||||
|
self._update_shift()
|
||||||
|
|
||||||
|
def _update_shift(self):
|
||||||
|
if self.shift_box.isChecked():
|
||||||
|
if self.ls_combobox.currentIndex() == 0:
|
||||||
|
num_points = self.ls_spinbox.value()
|
||||||
|
is_time = False
|
||||||
|
else:
|
||||||
|
num_points = float(self.ls_lineedit.text())
|
||||||
|
is_time = True
|
||||||
|
|
||||||
|
for i, y in enumerate(self._tmp_data_bl):
|
||||||
|
self._tmp_data_ls[i] = self._temp_leftshift(self.data[i].dx, y, num_points, is_time)
|
||||||
|
|
||||||
|
else:
|
||||||
|
for i, y in enumerate(self._tmp_data_bl):
|
||||||
|
self._tmp_data_ls[i] = y
|
||||||
|
|
||||||
|
self._update_zf()
|
||||||
|
|
||||||
|
def _update_zf(self):
|
||||||
|
zf_padding = self.zf_spinbox.value()
|
||||||
|
|
||||||
|
if self.zerofill_box.isChecked():
|
||||||
|
for i, y in enumerate(self._tmp_data_ls):
|
||||||
|
self._tmp_data_zf[i] = self._temp_zerofill(self.data[i].x, y, zf_padding)
|
||||||
|
|
||||||
|
else:
|
||||||
|
for i, y in enumerate(self._tmp_data_ls):
|
||||||
|
self._tmp_data_zf[i] = self.data[i].x, y
|
||||||
|
|
||||||
|
self._update_apod()
|
||||||
|
|
||||||
|
def _update_apod(self):
|
||||||
|
if self.apod_box.isChecked():
|
||||||
|
model = self.apods[self.apodcombobox.currentIndex()]
|
||||||
|
p = self._get_parameter()
|
||||||
|
|
||||||
|
x_limit = np.inf, -np.inf
|
||||||
|
y_limit = -np.inf
|
||||||
|
|
||||||
|
for i, (x, y) in enumerate(self._tmp_data_zf):
|
||||||
|
self._tmp_data_ap[i] = x, y * model.apod(x, *p)
|
||||||
|
y_limit = max(y.real.max(), y_limit)
|
||||||
|
x_limit = min(x_limit[0], x.min()), max(x_limit[1], x.max())
|
||||||
|
|
||||||
|
_x_apod = np.linspace(*x_limit, num=150)
|
||||||
|
_y_apod = model.apod(_x_apod, *p)
|
||||||
|
self.apod_graph.setData(x=_x_apod, y=y_limit * _y_apod)
|
||||||
|
self.apod_graph.show()
|
||||||
|
|
||||||
|
else:
|
||||||
|
for i, (x, y) in enumerate(self._tmp_data_zf):
|
||||||
|
self._tmp_data_ap[i] = x, y
|
||||||
|
|
||||||
|
self.apod_graph.hide()
|
||||||
|
|
||||||
|
self._update_phase()
|
||||||
|
|
||||||
|
def _update_phase(self):
|
||||||
|
if self.phase_box.isChecked():
|
||||||
|
pvt = float(self.pivot_lineedit.text())
|
||||||
|
self.pvt_line.show()
|
||||||
|
ph0 = self.ph0_spinbox.value()
|
||||||
|
ph1 = self.ph1_spinbox.value()
|
||||||
|
|
||||||
|
for i, (x, y) in enumerate(self._tmp_data_ap):
|
||||||
|
x_fft, y_fft = self._temp_fft(x, y)
|
||||||
|
|
||||||
|
if ph0 != 0:
|
||||||
|
y = self._temp_phase(x, y, ph0, 0, 0)
|
||||||
|
y_fft = self._temp_phase(x, y_fft, ph0, ph1, pvt)
|
||||||
|
elif ph1 != 0:
|
||||||
|
y_fft = self._temp_phase(x, y_fft, ph0, ph1, pvt)
|
||||||
|
|
||||||
|
self._tmp_data_ph[i] = x, y, x_fft, y_fft
|
||||||
|
|
||||||
|
else:
|
||||||
|
self.pvt_line.hide()
|
||||||
|
for i, (x, y) in enumerate(self._tmp_data_ap):
|
||||||
|
self._tmp_data_ph[i] = x, y, *self._temp_fft(x, y)
|
||||||
|
|
||||||
|
self._update_plots()
|
||||||
|
|
||||||
|
def _update_plots(self):
|
||||||
|
for i, (x, y, xf, yf) in enumerate(self._tmp_data_ph):
|
||||||
|
self.graphs[i][0].setData(x=x, y=y.real)
|
||||||
|
self.graphs[i][1].setData(x=x, y=y.imag)
|
||||||
|
|
||||||
|
self.graphs[i][2].setData(x=xf, y=yf.real)
|
||||||
|
self.graphs[i][3].setData(x=xf, y=yf.imag)
|
||||||
|
|
||||||
|
@staticmethod
|
||||||
|
def _temp_phase(x: np.ndarray, y: np.ndarray, ph0: float, ph1: float, pvt: float) -> np.ndarray:
|
||||||
|
phase_correction = np.exp(-1j * (ph0 + ph1 * (x - pvt) / x.max()) * pi / 180.)
|
||||||
|
_y = y * phase_correction
|
||||||
|
|
||||||
|
return _y
|
||||||
|
|
||||||
|
@staticmethod
|
||||||
|
def _temp_zerofill(x: np.ndarray, y: np.ndarray, num_padding: int) -> tuple[np.ndarray, np.ndarray]:
|
||||||
|
length = x.size
|
||||||
|
factor = 2**num_padding
|
||||||
|
|
||||||
|
_y = np.r_[y, np.zeros((factor-1) * length)]
|
||||||
|
|
||||||
|
_temp_x = np.arange(1, (factor-1) * length+1) * (x[1]-x[0]) + np.max(x)
|
||||||
|
_x = np.r_[x, _temp_x]
|
||||||
|
|
||||||
|
return _x, _y
|
||||||
|
|
||||||
|
@staticmethod
|
||||||
|
def _temp_leftshift(dx: np.ndarray, y: np.ndarray, points: float | int, is_time: bool) -> np.ndarray:
|
||||||
|
if is_time:
|
||||||
|
points = int(points//dx)
|
||||||
|
_y = np.roll(y, -points)
|
||||||
|
_y[-points-1:] = 0
|
||||||
|
|
||||||
|
return _y
|
||||||
|
|
||||||
|
@staticmethod
|
||||||
|
def _temp_fft(x: np.ndarray, y: np.ndarray) -> tuple[np.ndarray, np.ndarray]:
|
||||||
y_fft = fftshift(fft(y))
|
y_fft = fftshift(fft(y))
|
||||||
x_fft = fftshift(fftfreq(len(x), d=x[1]-x[0]))
|
x_fft = fftshift(fftfreq(len(x), d=x[1]-x[0]))
|
||||||
real_plt_fft = PlotItem(x=x_fft, y=y_fft.real, pen=mkPen('b'))
|
|
||||||
# imag_plt_fft = pg.PlotDataItem(x=x_fft, y=y_fft.imag, pen=pg.mkPen('b'))
|
|
||||||
self.graphicsView_2.addItem(real_plt_fft)
|
|
||||||
# self.graphicsView_2.addItem(imag_plt_fft)
|
|
||||||
|
|
||||||
self.graphs.append((real_plt, real_plt_fft))
|
return x_fft, y_fft
|
||||||
self.data.append((x, y, x_fft))
|
|
||||||
|
|
||||||
xlimits = (max(x.min(), self._limits[0][0]), min(x.max(), self._limits[0][1]))
|
def move_line(self, evt):
|
||||||
ylimit = max(self._limits[1], y.real.max())
|
self.pivot_lineedit.setText(f'{evt.value():.5g}')
|
||||||
self._limits = xlimits, ylimit
|
|
||||||
|
|
||||||
@QtCore.pyqtSlot(int, name='on_apodcombobox_currentIndexChanged')
|
@QtCore.pyqtSlot(int, name='on_apodcombobox_currentIndexChanged')
|
||||||
def change_apodization(self, index):
|
def change_apodization(self, index: int) -> None:
|
||||||
# delete old widgets
|
# delete old widgets
|
||||||
self.eqn_label.setText(convert(self.apods[index].equation))
|
self.eqn_label.setText(convert(self.apods[index].equation))
|
||||||
while self.widget_layout.count():
|
while self.widget_layout.count():
|
||||||
item = self.widget_layout.takeAt(0)
|
item = self.widget_layout.takeAt(0)
|
||||||
|
if isinstance(item, FormWidget):
|
||||||
|
item.disconnect()
|
||||||
|
|
||||||
try:
|
try:
|
||||||
item.widget().deleteLater()
|
item.widget().deleteLater()
|
||||||
except AttributeError:
|
except AttributeError:
|
||||||
pass
|
pass
|
||||||
|
|
||||||
# set up parameter widgets for new model
|
# set up parameter widgets for new model
|
||||||
for k, v in enumerate(self.apods[index]().params):
|
for k, v in enumerate(self.apods[index].params):
|
||||||
widgt = FormWidget(name=v)
|
widget = FormWidget(name=v)
|
||||||
widgt.valueChanged.connect(self._temp_apod)
|
widget.value = 1
|
||||||
self.widget_layout.addWidget(widgt)
|
widget.valueChanged.connect(self._update_apod)
|
||||||
|
self.widget_layout.addWidget(widget)
|
||||||
|
|
||||||
self.widget_layout.addStretch()
|
self.widget_layout.addStretch()
|
||||||
self._temp_apod()
|
self._update_apod()
|
||||||
|
|
||||||
def _temp_apod(self):
|
|
||||||
apodmodel = self.apods[self.apodcombobox.currentIndex()]
|
|
||||||
p = self._get_parameter()
|
|
||||||
|
|
||||||
if self.data:
|
|
||||||
for i, (x, y, x_fft) in enumerate(self.data):
|
|
||||||
y2 = apodmodel.apod(x, *p)
|
|
||||||
_y = y2 * y
|
|
||||||
self.graphs[i][0].setData(x=x, y=_y.real)
|
|
||||||
# self.graphs[i][1].setData(y=_y.imag)
|
|
||||||
y_fft = fftshift(fft(_y))
|
|
||||||
self.graphs[i][1].setData(x=x_fft, y=y_fft.real)
|
|
||||||
# self.graphs[i][3].setData(y=y_fft.imag)
|
|
||||||
|
|
||||||
_x_apod = linspace(self._limits[0][0], self._limits[0][1])
|
|
||||||
try:
|
|
||||||
_y_apod = apodmodel.apod(_x_apod, *p)
|
|
||||||
self.apod_graph.setData(x=_x_apod, y=self._limits[1]*_y_apod)
|
|
||||||
except IndexError:
|
|
||||||
pass
|
|
||||||
|
|
||||||
def _get_parameter(self):
|
def _get_parameter(self):
|
||||||
p = []
|
p = []
|
||||||
@ -201,8 +299,78 @@ class QApodDialog(QPreviewDialogs, Ui_ApodEdit):
|
|||||||
|
|
||||||
return p
|
return p
|
||||||
|
|
||||||
def get_value(self):
|
@QtCore.pyqtSlot(int, name='on_ls_combobox_currentIndexChanged')
|
||||||
apodmodel = self.apods[self.apodcombobox.currentIndex()]
|
def change_ls(self, idx: int) -> None:
|
||||||
p = self._get_parameter()
|
self.ls_lineedit.setVisible(bool(idx))
|
||||||
|
self.ls_spinbox.setVisible(not bool(idx))
|
||||||
|
|
||||||
return p, apodmodel
|
@QtCore.pyqtSlot(bool, name='on_ft_checkbox_stateChanged')
|
||||||
|
def change_ft(self, state: bool):
|
||||||
|
self.ph1_spinbox.setEnabled(state)
|
||||||
|
self.pivot_lineedit.setEnabled(state)
|
||||||
|
|
||||||
|
def cleanup(self):
|
||||||
|
self.blockSignals(True)
|
||||||
|
|
||||||
|
for line in self.graphs:
|
||||||
|
for g in line:
|
||||||
|
self.time_graph.removeItem(g)
|
||||||
|
self.freq_graph.removeItem(g)
|
||||||
|
del g
|
||||||
|
|
||||||
|
self.time_graph.clear()
|
||||||
|
self.freq_graph.clear()
|
||||||
|
|
||||||
|
self._tmp_data_ap = []
|
||||||
|
self._tmp_data_bl = []
|
||||||
|
self._tmp_data_ls = []
|
||||||
|
self._tmp_data_ph = []
|
||||||
|
self._tmp_data_zf = []
|
||||||
|
|
||||||
|
self.data = []
|
||||||
|
self.graphs = []
|
||||||
|
|
||||||
|
self.blockSignals(False)
|
||||||
|
|
||||||
|
def get_value(self):
|
||||||
|
edits = [(None,), (None,), (None,), (None,), (None,), (None,)]
|
||||||
|
|
||||||
|
if self.baseline_box.isChecked():
|
||||||
|
edits[0] = (True,)
|
||||||
|
|
||||||
|
if self.zerofill_box.isChecked():
|
||||||
|
edits[2] = (self.zf_spinbox.value(),)
|
||||||
|
|
||||||
|
if self.shift_box.isChecked():
|
||||||
|
if self.ls_combobox.currentIndex() == 0:
|
||||||
|
edits[1] = (self.ls_spinbox.value(), 'pts')
|
||||||
|
else:
|
||||||
|
edits[1] = (float(self.ls_lineedit.text()), 'time')
|
||||||
|
|
||||||
|
if self.apod_box.isChecked():
|
||||||
|
edits[3] = (self._get_parameter(), self.apods[self.apodcombobox.currentIndex()])
|
||||||
|
|
||||||
|
if self.phase_box.isChecked():
|
||||||
|
edits[4] = (self.ph0_spinbox.value(), self.ph1_spinbox.value(), float(self.pivot_lineedit.text()))
|
||||||
|
|
||||||
|
if self.ft_box.isChecked():
|
||||||
|
edits[5] = (self.phase_before_button.isChecked(),)
|
||||||
|
|
||||||
|
return edits
|
||||||
|
|
||||||
|
def exec(self):
|
||||||
|
self._prepare_ui()
|
||||||
|
return super().exec()
|
||||||
|
|
||||||
|
def _prepare_ui(self):
|
||||||
|
"""Stuff we have to do before showing the window but after all the data was added"""
|
||||||
|
|
||||||
|
vb = self.freq_graph.getPlotItem().getViewBox()
|
||||||
|
vb.disableAutoRange(axis=vb.YAxis)
|
||||||
|
|
||||||
|
vb = self.time_graph.getPlotItem().getViewBox()
|
||||||
|
vb.disableAutoRange(axis=vb.YAxis)
|
||||||
|
|
||||||
|
self.zerofill_box.setVisible(self._all_time)
|
||||||
|
self.apod_box.setVisible(self._all_time)
|
||||||
|
self.shift_box.setVisible(self._all_time)
|
||||||
|
@ -87,6 +87,21 @@ class ShiftCommand(QtWidgets.QUndoCommand):
|
|||||||
self.__data.apply('ls', self.__args)
|
self.__data.apply('ls', self.__args)
|
||||||
|
|
||||||
|
|
||||||
|
class EditCommand(QtWidgets.QUndoCommand):
|
||||||
|
def __init__(self, data, *args):
|
||||||
|
super().__init__('Edit signal')
|
||||||
|
|
||||||
|
self.__data = data
|
||||||
|
self.__arguments = args
|
||||||
|
self.__original = copy.deepcopy(self.__data.data)
|
||||||
|
|
||||||
|
def undo(self):
|
||||||
|
self.__data.data = copy.deepcopy(self.__original)
|
||||||
|
|
||||||
|
def redo(self):
|
||||||
|
self.__data.edit_signal(*self.__arguments)
|
||||||
|
|
||||||
|
|
||||||
class NormCommand(QtWidgets.QUndoCommand):
|
class NormCommand(QtWidgets.QUndoCommand):
|
||||||
def __init__(self, data, mode):
|
def __init__(self, data, mode):
|
||||||
super().__init__('Normalize')
|
super().__init__('Normalize')
|
||||||
|
@ -15,7 +15,7 @@ from nmreval.io.sessionwriter import NMRWriter
|
|||||||
from .management import UpperManagement
|
from .management import UpperManagement
|
||||||
from ..Qt import QtGui, QtPrintSupport
|
from ..Qt import QtGui, QtPrintSupport
|
||||||
from ..data.shift_graphs import QShift
|
from ..data.shift_graphs import QShift
|
||||||
from ..data.signaledit import QApodDialog, QBaselineDialog, QPhasedialog
|
from ..data.signaledit import QPreviewDialog, QBaselineDialog
|
||||||
from ..dsc.glass_dialog import TgCalculator
|
from ..dsc.glass_dialog import TgCalculator
|
||||||
from ..fit.result import FitExtension, QFitResult
|
from ..fit.result import FitExtension, QFitResult
|
||||||
from ..graphs.graphwindow import QGraphWindow
|
from ..graphs.graphwindow import QGraphWindow
|
||||||
@ -164,7 +164,7 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
|||||||
self.ac_group2.triggered.connect(self.change_fit_limits)
|
self.ac_group2.triggered.connect(self.change_fit_limits)
|
||||||
|
|
||||||
self.t1action.triggered.connect(lambda: self._show_tab('t1_temp'))
|
self.t1action.triggered.connect(lambda: self._show_tab('t1_temp'))
|
||||||
self.action_edit.triggered.connect(lambda: self._show_tab('signal'))
|
self.action_edit.triggered.connect(self.do_preview)
|
||||||
self.actionPick_position.triggered.connect(lambda: self._show_tab('pick'))
|
self.actionPick_position.triggered.connect(lambda: self._show_tab('pick'))
|
||||||
self.actionIntegration.triggered.connect(lambda: self._show_tab('integrate'))
|
self.actionIntegration.triggered.connect(lambda: self._show_tab('integrate'))
|
||||||
self.action_FitWidget.triggered.connect(lambda: self._show_tab('fit'))
|
self.action_FitWidget.triggered.connect(lambda: self._show_tab('fit'))
|
||||||
@ -214,7 +214,7 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
|||||||
self.t1tauwidget.newData.connect(self.management.add_new_data)
|
self.t1tauwidget.newData.connect(self.management.add_new_data)
|
||||||
|
|
||||||
self.editsignalwidget.do_something.connect(self.management.apply)
|
self.editsignalwidget.do_something.connect(self.management.apply)
|
||||||
self.editsignalwidget.preview_triggered.connect(self.do_preview)
|
# self.editsignalwidget.preview_triggered.connect(self.do_preview)
|
||||||
|
|
||||||
self.action_sort_pts.triggered.connect(lambda: self.management.apply('sort', ()))
|
self.action_sort_pts.triggered.connect(lambda: self.management.apply('sort', ()))
|
||||||
self.action_calc_eps_derivative.triggered.connect(self.management.bds_deriv)
|
self.action_calc_eps_derivative.triggered.connect(self.management.bds_deriv)
|
||||||
@ -784,29 +784,22 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
|||||||
editor.finished.connect(self.management.apply)
|
editor.finished.connect(self.management.apply)
|
||||||
editor.exec()
|
editor.exec()
|
||||||
|
|
||||||
@QtCore.pyqtSlot(str)
|
@QtCore.pyqtSlot()
|
||||||
def do_preview(self, mode):
|
def do_preview(self):
|
||||||
|
dialog = QPreviewDialog(self)
|
||||||
|
|
||||||
if mode == 'ap':
|
success = True
|
||||||
dialog = QApodDialog(parent=self)
|
|
||||||
elif mode == 'ph':
|
|
||||||
dialog = QPhasedialog(parent=self)
|
|
||||||
else:
|
|
||||||
raise ValueError('Unknown preview mode %s' % str(mode))
|
|
||||||
|
|
||||||
dialog.setRange(*self.current_graph_widget.ranges, self.current_graph_widget.log)
|
|
||||||
|
|
||||||
for sid in self.current_graph_widget.active:
|
for sid in self.current_graph_widget.active:
|
||||||
data_mode = self.management[sid].mode
|
data_mode = self.management[sid].mode
|
||||||
tobeadded = False
|
if data_mode in ('fid', 'spectrum'):
|
||||||
if (data_mode == 'fid') or (data_mode == 'spectrum' and mode == 'ph'):
|
success = dialog.add_data(self.management[sid].data)
|
||||||
tobeadded = True
|
|
||||||
|
|
||||||
if tobeadded:
|
if not success:
|
||||||
dialog.add_data(*self.management.get_data(sid, xy_only=True))
|
break
|
||||||
|
|
||||||
if dialog.exec() == QtWidgets.QDialog.Accepted:
|
if success and dialog.exec() == QtWidgets.QDialog.Accepted:
|
||||||
self.management.apply(mode, dialog.get_value())
|
self.management.edit_signals(dialog.get_value())
|
||||||
|
|
||||||
@QtCore.pyqtSlot(name='on_actionMove_between_plots_triggered')
|
@QtCore.pyqtSlot(name='on_actionMove_between_plots_triggered')
|
||||||
def move_sets_dialog(self):
|
def move_sets_dialog(self):
|
||||||
|
@ -418,6 +418,13 @@ class UpperManagement(QtCore.QObject):
|
|||||||
self.undostack.push(single_undo)
|
self.undostack.push(single_undo)
|
||||||
self.undostack.endMacro()
|
self.undostack.endMacro()
|
||||||
|
|
||||||
|
def edit_signals(self: UpperManagement, args: list[tuple]) -> None:
|
||||||
|
self.undostack.beginMacro('Edit signals')
|
||||||
|
for sid in self.graphs[self.current_graph]:
|
||||||
|
single_undo = EditCommand(self.data[sid], *args)
|
||||||
|
self.undostack.push(single_undo)
|
||||||
|
self.undostack.endMacro()
|
||||||
|
|
||||||
def cut(self):
|
def cut(self):
|
||||||
if self.current_graph:
|
if self.current_graph:
|
||||||
xlim, _ = self.graphs[self.current_graph].ranges
|
xlim, _ = self.graphs[self.current_graph].ranges
|
||||||
|
@ -62,6 +62,10 @@ class FID(Signal):
|
|||||||
|
|
||||||
return self
|
return self
|
||||||
|
|
||||||
|
def manual_phase(self, ph0: float = 0., ph1: float = 0., pvt: float = 0):
|
||||||
|
"""FID knows only how to phase correct in zeroth order"""
|
||||||
|
super().manual_phase(ph0=ph0)
|
||||||
|
|
||||||
def fourier(self) -> 'Spectrum':
|
def fourier(self) -> 'Spectrum':
|
||||||
ft = np.fft.fftshift(np.fft.fft(self._y)) / self.dx
|
ft = np.fft.fftshift(np.fft.fft(self._y)) / self.dx
|
||||||
freq = np.fft.fftshift(np.fft.fftfreq(self.length, self.dx))
|
freq = np.fft.fftshift(np.fft.fftfreq(self.length, self.dx))
|
||||||
|
@ -319,20 +319,21 @@ class Points:
|
|||||||
if pts is None:
|
if pts is None:
|
||||||
pts = []
|
pts = []
|
||||||
|
|
||||||
for x in idx:
|
if idx is not None:
|
||||||
if isinstance(x, tuple):
|
for x in idx:
|
||||||
x_idx = np.argmin(np.abs(self._x[self.mask] - (x[0]+x[1])/2))
|
if isinstance(x, tuple):
|
||||||
left_b = np.argmin(np.abs(self._x[self.mask] - x[0]))
|
x_idx = np.argmin(np.abs(self._x[self.mask] - (x[0]+x[1])/2))
|
||||||
right_b = np.argmin(np.abs(self._x[self.mask] - x[1]))
|
left_b = np.argmin(np.abs(self._x[self.mask] - x[0]))
|
||||||
else:
|
right_b = np.argmin(np.abs(self._x[self.mask] - x[1]))
|
||||||
x_idx = np.argmin(np.abs(self._x[self.mask]-x))
|
else:
|
||||||
left_b = int(max(0, x_idx - avg_range[0]))
|
x_idx = np.argmin(np.abs(self._x[self.mask]-x))
|
||||||
right_b = int(min(len(self), x_idx + avg_range[1] + 1))
|
left_b = int(max(0, x_idx - avg_range[0]))
|
||||||
|
right_b = int(min(len(self), x_idx + avg_range[1] + 1))
|
||||||
|
|
||||||
if left_b < right_b:
|
if left_b < right_b:
|
||||||
pts.append([self._x[x_idx], *self._average(avg_mode, x_idx, left_b, right_b)])
|
pts.append([self._x[x_idx], *self._average(avg_mode, x_idx, left_b, right_b)])
|
||||||
else:
|
else:
|
||||||
pts.append([self._x[x_idx], self._y[x_idx], self._y_err[x_idx]])
|
pts.append([self._x[x_idx], self._y[x_idx], self._y_err[x_idx]])
|
||||||
|
|
||||||
if special is not None:
|
if special is not None:
|
||||||
if special not in ['max', 'min', 'absmax', 'absmin']:
|
if special not in ['max', 'min', 'absmax', 'absmin']:
|
||||||
|
@ -6,8 +6,8 @@
|
|||||||
<rect>
|
<rect>
|
||||||
<x>0</x>
|
<x>0</x>
|
||||||
<y>0</y>
|
<y>0</y>
|
||||||
<width>784</width>
|
<width>1144</width>
|
||||||
<height>484</height>
|
<height>655</height>
|
||||||
</rect>
|
</rect>
|
||||||
</property>
|
</property>
|
||||||
<property name="sizePolicy">
|
<property name="sizePolicy">
|
||||||
@ -21,22 +21,22 @@
|
|||||||
</property>
|
</property>
|
||||||
<layout class="QGridLayout" name="gridLayout">
|
<layout class="QGridLayout" name="gridLayout">
|
||||||
<property name="leftMargin">
|
<property name="leftMargin">
|
||||||
<number>3</number>
|
<number>9</number>
|
||||||
</property>
|
</property>
|
||||||
<property name="topMargin">
|
<property name="topMargin">
|
||||||
<number>3</number>
|
<number>9</number>
|
||||||
</property>
|
</property>
|
||||||
<property name="rightMargin">
|
<property name="rightMargin">
|
||||||
<number>3</number>
|
<number>9</number>
|
||||||
</property>
|
</property>
|
||||||
<property name="bottomMargin">
|
<property name="bottomMargin">
|
||||||
<number>3</number>
|
<number>9</number>
|
||||||
</property>
|
</property>
|
||||||
<property name="spacing">
|
<property name="spacing">
|
||||||
<number>3</number>
|
<number>3</number>
|
||||||
</property>
|
</property>
|
||||||
<item row="2" column="0">
|
<item row="2" column="1">
|
||||||
<widget class="NMRPlotWidget" name="graphicsView">
|
<widget class="NMRPlotWidget" name="time_graph">
|
||||||
<property name="sizePolicy">
|
<property name="sizePolicy">
|
||||||
<sizepolicy hsizetype="MinimumExpanding" vsizetype="Expanding">
|
<sizepolicy hsizetype="MinimumExpanding" vsizetype="Expanding">
|
||||||
<horstretch>0</horstretch>
|
<horstretch>0</horstretch>
|
||||||
@ -45,30 +45,10 @@
|
|||||||
</property>
|
</property>
|
||||||
</widget>
|
</widget>
|
||||||
</item>
|
</item>
|
||||||
<item row="2" column="1">
|
<item row="2" column="2">
|
||||||
<widget class="NMRPlotWidget" name="graphicsView_2"/>
|
<widget class="NMRPlotWidget" name="freq_graph"/>
|
||||||
</item>
|
</item>
|
||||||
<item row="0" column="0">
|
<item row="4" column="1" colspan="2">
|
||||||
<widget class="QComboBox" name="apodcombobox">
|
|
||||||
<property name="sizePolicy">
|
|
||||||
<sizepolicy hsizetype="MinimumExpanding" vsizetype="Fixed">
|
|
||||||
<horstretch>0</horstretch>
|
|
||||||
<verstretch>0</verstretch>
|
|
||||||
</sizepolicy>
|
|
||||||
</property>
|
|
||||||
</widget>
|
|
||||||
</item>
|
|
||||||
<item row="1" column="0" colspan="2">
|
|
||||||
<layout class="QHBoxLayout" name="widget_layout">
|
|
||||||
<property name="spacing">
|
|
||||||
<number>20</number>
|
|
||||||
</property>
|
|
||||||
<property name="topMargin">
|
|
||||||
<number>6</number>
|
|
||||||
</property>
|
|
||||||
</layout>
|
|
||||||
</item>
|
|
||||||
<item row="4" column="0" colspan="2">
|
|
||||||
<widget class="QDialogButtonBox" name="buttonBox">
|
<widget class="QDialogButtonBox" name="buttonBox">
|
||||||
<property name="orientation">
|
<property name="orientation">
|
||||||
<enum>Qt::Horizontal</enum>
|
<enum>Qt::Horizontal</enum>
|
||||||
@ -78,20 +58,361 @@
|
|||||||
</property>
|
</property>
|
||||||
</widget>
|
</widget>
|
||||||
</item>
|
</item>
|
||||||
<item row="0" column="1">
|
<item row="2" column="0">
|
||||||
<widget class="QLabel" name="eqn_label">
|
<widget class="QWidget" name="widget" native="true">
|
||||||
<property name="sizePolicy">
|
<property name="sizePolicy">
|
||||||
<sizepolicy hsizetype="MinimumExpanding" vsizetype="Preferred">
|
<sizepolicy hsizetype="Maximum" vsizetype="Preferred">
|
||||||
<horstretch>0</horstretch>
|
<horstretch>0</horstretch>
|
||||||
<verstretch>0</verstretch>
|
<verstretch>0</verstretch>
|
||||||
</sizepolicy>
|
</sizepolicy>
|
||||||
</property>
|
</property>
|
||||||
<property name="text">
|
<layout class="QVBoxLayout" name="verticalLayout">
|
||||||
<string>TextLabel</string>
|
<item>
|
||||||
</property>
|
<widget class="QCheckBox" name="baseline_box">
|
||||||
<property name="indent">
|
<property name="text">
|
||||||
<number>3</number>
|
<string>Baseline</string>
|
||||||
</property>
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QGroupBox" name="shift_box">
|
||||||
|
<property name="title">
|
||||||
|
<string>Shift</string>
|
||||||
|
</property>
|
||||||
|
<property name="flat">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checkable">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checked">
|
||||||
|
<bool>false</bool>
|
||||||
|
</property>
|
||||||
|
<layout class="QGridLayout" name="gridLayout_4">
|
||||||
|
<property name="leftMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="topMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="rightMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="bottomMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="spacing">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<item row="1" column="1">
|
||||||
|
<widget class="QLineEdit" name="ls_lineedit">
|
||||||
|
<property name="text">
|
||||||
|
<string>0</string>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item row="0" column="1">
|
||||||
|
<widget class="QSpinBox" name="ls_spinbox">
|
||||||
|
<property name="maximum">
|
||||||
|
<number>999999</number>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item row="0" column="0" rowspan="2">
|
||||||
|
<widget class="QComboBox" name="ls_combobox">
|
||||||
|
<item>
|
||||||
|
<property name="text">
|
||||||
|
<string>Points</string>
|
||||||
|
</property>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<property name="text">
|
||||||
|
<string>Seconds</string>
|
||||||
|
</property>
|
||||||
|
</item>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
</layout>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QGroupBox" name="apod_box">
|
||||||
|
<property name="title">
|
||||||
|
<string>Apodization</string>
|
||||||
|
</property>
|
||||||
|
<property name="flat">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checkable">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checked">
|
||||||
|
<bool>false</bool>
|
||||||
|
</property>
|
||||||
|
<layout class="QVBoxLayout" name="verticalLayout_2">
|
||||||
|
<property name="spacing">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="leftMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="topMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="rightMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="bottomMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<item>
|
||||||
|
<widget class="QComboBox" name="apodcombobox"/>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QLabel" name="eqn_label">
|
||||||
|
<property name="text">
|
||||||
|
<string>TextLabel</string>
|
||||||
|
</property>
|
||||||
|
<property name="indent">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<layout class="QHBoxLayout" name="widget_layout">
|
||||||
|
<property name="spacing">
|
||||||
|
<number>20</number>
|
||||||
|
</property>
|
||||||
|
<property name="topMargin">
|
||||||
|
<number>6</number>
|
||||||
|
</property>
|
||||||
|
</layout>
|
||||||
|
</item>
|
||||||
|
</layout>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QGroupBox" name="zerofill_box">
|
||||||
|
<property name="title">
|
||||||
|
<string>Zero fill</string>
|
||||||
|
</property>
|
||||||
|
<property name="flat">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checkable">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checked">
|
||||||
|
<bool>false</bool>
|
||||||
|
</property>
|
||||||
|
<layout class="QHBoxLayout" name="horizontalLayout">
|
||||||
|
<property name="spacing">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="leftMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="topMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="rightMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="bottomMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<item>
|
||||||
|
<widget class="QLabel" name="label">
|
||||||
|
<property name="text">
|
||||||
|
<string>Double length</string>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QSpinBox" name="zf_spinbox">
|
||||||
|
<property name="suffix">
|
||||||
|
<string>x</string>
|
||||||
|
</property>
|
||||||
|
<property name="minimum">
|
||||||
|
<number>1</number>
|
||||||
|
</property>
|
||||||
|
<property name="maximum">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
</layout>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QGroupBox" name="phase_box">
|
||||||
|
<property name="title">
|
||||||
|
<string>Phase correction</string>
|
||||||
|
</property>
|
||||||
|
<property name="flat">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checkable">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checked">
|
||||||
|
<bool>false</bool>
|
||||||
|
</property>
|
||||||
|
<layout class="QGridLayout" name="gridLayout_2">
|
||||||
|
<property name="leftMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="topMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="rightMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="bottomMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="spacing">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<item row="1" column="0">
|
||||||
|
<widget class="QLabel" name="label_3">
|
||||||
|
<property name="text">
|
||||||
|
<string>Phase 1</string>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item row="2" column="0">
|
||||||
|
<widget class="QLabel" name="label_4">
|
||||||
|
<property name="text">
|
||||||
|
<string>Pivot</string>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item row="0" column="1">
|
||||||
|
<widget class="QDoubleSpinBox" name="ph0_spinbox">
|
||||||
|
<property name="wrapping">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="decimals">
|
||||||
|
<number>1</number>
|
||||||
|
</property>
|
||||||
|
<property name="minimum">
|
||||||
|
<double>-180.000000000000000</double>
|
||||||
|
</property>
|
||||||
|
<property name="maximum">
|
||||||
|
<double>180.000000000000000</double>
|
||||||
|
</property>
|
||||||
|
<property name="singleStep">
|
||||||
|
<double>0.500000000000000</double>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item row="2" column="1">
|
||||||
|
<widget class="QLineEdit" name="pivot_lineedit">
|
||||||
|
<property name="text">
|
||||||
|
<string>0</string>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item row="0" column="0">
|
||||||
|
<widget class="QLabel" name="label_2">
|
||||||
|
<property name="text">
|
||||||
|
<string>Phase 0</string>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item row="1" column="1">
|
||||||
|
<widget class="QDoubleSpinBox" name="ph1_spinbox">
|
||||||
|
<property name="wrapping">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="decimals">
|
||||||
|
<number>2</number>
|
||||||
|
</property>
|
||||||
|
<property name="minimum">
|
||||||
|
<double>-720.000000000000000</double>
|
||||||
|
</property>
|
||||||
|
<property name="maximum">
|
||||||
|
<double>720.000000000000000</double>
|
||||||
|
</property>
|
||||||
|
<property name="singleStep">
|
||||||
|
<double>0.050000000000000</double>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
</layout>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QGroupBox" name="ft_box">
|
||||||
|
<property name="title">
|
||||||
|
<string>Fourier transform</string>
|
||||||
|
</property>
|
||||||
|
<property name="checkable">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<property name="checked">
|
||||||
|
<bool>false</bool>
|
||||||
|
</property>
|
||||||
|
<layout class="QVBoxLayout" name="verticalLayout_3">
|
||||||
|
<property name="spacing">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="leftMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="topMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="rightMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<property name="bottomMargin">
|
||||||
|
<number>3</number>
|
||||||
|
</property>
|
||||||
|
<item>
|
||||||
|
<widget class="QRadioButton" name="phase_before_button">
|
||||||
|
<property name="text">
|
||||||
|
<string>before phase correction</string>
|
||||||
|
</property>
|
||||||
|
<property name="checked">
|
||||||
|
<bool>true</bool>
|
||||||
|
</property>
|
||||||
|
<attribute name="buttonGroup">
|
||||||
|
<string notr="true">buttonGroup</string>
|
||||||
|
</attribute>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QRadioButton" name="phase_after_button">
|
||||||
|
<property name="text">
|
||||||
|
<string>after phase correction</string>
|
||||||
|
</property>
|
||||||
|
<attribute name="buttonGroup">
|
||||||
|
<string notr="true">buttonGroup</string>
|
||||||
|
</attribute>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
</layout>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
|
<item>
|
||||||
|
<spacer name="verticalSpacer">
|
||||||
|
<property name="orientation">
|
||||||
|
<enum>Qt::Vertical</enum>
|
||||||
|
</property>
|
||||||
|
<property name="sizeType">
|
||||||
|
<enum>QSizePolicy::Expanding</enum>
|
||||||
|
</property>
|
||||||
|
<property name="sizeHint" stdset="0">
|
||||||
|
<size>
|
||||||
|
<width>20</width>
|
||||||
|
<height>40</height>
|
||||||
|
</size>
|
||||||
|
</property>
|
||||||
|
</spacer>
|
||||||
|
</item>
|
||||||
|
</layout>
|
||||||
</widget>
|
</widget>
|
||||||
</item>
|
</item>
|
||||||
</layout>
|
</layout>
|
||||||
@ -138,4 +459,7 @@
|
|||||||
</hints>
|
</hints>
|
||||||
</connection>
|
</connection>
|
||||||
</connections>
|
</connections>
|
||||||
|
<buttongroups>
|
||||||
|
<buttongroup name="buttonGroup"/>
|
||||||
|
</buttongroups>
|
||||||
</ui>
|
</ui>
|
||||||
|
Loading…
Reference in New Issue
Block a user