forked from IPKM/nmreval
194-fitrange (#219)
keyboard-setting of custom fit range; closes #194; helps for #32
This commit is contained in:
parent
06491ff413
commit
465fb0c09a
@ -1,6 +1,6 @@
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# -*- coding: utf-8 -*-
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# -*- coding: utf-8 -*-
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# Form implementation generated from reading ui file 'resources/_ui/basewindow.ui'
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# Form implementation generated from reading ui file 'src/resources/_ui/basewindow.ui'
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#
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#
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# Created by: PyQt5 UI code generator 5.15.10
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# Created by: PyQt5 UI code generator 5.15.10
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#
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#
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@ -153,15 +153,6 @@ class Ui_BaseWindow(object):
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self.toolBar_nmr.setIconSize(QtCore.QSize(24, 24))
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self.toolBar_nmr.setIconSize(QtCore.QSize(24, 24))
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self.toolBar_nmr.setObjectName("toolBar_nmr")
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self.toolBar_nmr.setObjectName("toolBar_nmr")
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BaseWindow.addToolBar(QtCore.Qt.TopToolBarArea, self.toolBar_nmr)
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BaseWindow.addToolBar(QtCore.Qt.TopToolBarArea, self.toolBar_nmr)
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self.toolBar_fit = QtWidgets.QToolBar(BaseWindow)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Fixed, QtWidgets.QSizePolicy.Fixed)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(self.toolBar_fit.sizePolicy().hasHeightForWidth())
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self.toolBar_fit.setSizePolicy(sizePolicy)
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self.toolBar_fit.setIconSize(QtCore.QSize(24, 24))
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self.toolBar_fit.setObjectName("toolBar_fit")
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BaseWindow.addToolBar(QtCore.Qt.TopToolBarArea, self.toolBar_fit)
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self.toolBar_spectrum = QtWidgets.QToolBar(BaseWindow)
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self.toolBar_spectrum = QtWidgets.QToolBar(BaseWindow)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Preferred, QtWidgets.QSizePolicy.Fixed)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Preferred, QtWidgets.QSizePolicy.Fixed)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setHorizontalStretch(0)
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@ -496,7 +487,6 @@ class Ui_BaseWindow(object):
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self.toolbar_edit.addAction(self.actionShift)
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self.toolbar_edit.addAction(self.actionShift)
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self.toolBar_nmr.addAction(self.t1action)
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self.toolBar_nmr.addAction(self.t1action)
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self.toolBar_nmr.addAction(self.actionCalculateT1)
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self.toolBar_nmr.addAction(self.actionCalculateT1)
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self.toolBar_fit.addAction(self.action_FitWidget)
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self.toolBar_spectrum.addAction(self.action_edit)
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self.toolBar_spectrum.addAction(self.action_edit)
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self.toolBar_spectrum.addAction(self.actionPick_position)
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self.toolBar_spectrum.addAction(self.actionPick_position)
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self.toolBar_data.addAction(self.actionConcatenate_sets)
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self.toolBar_data.addAction(self.actionConcatenate_sets)
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@ -537,7 +527,6 @@ class Ui_BaseWindow(object):
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self.toolBar.setWindowTitle(_translate("BaseWindow", "Main"))
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self.toolBar.setWindowTitle(_translate("BaseWindow", "Main"))
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self.toolbar_edit.setWindowTitle(_translate("BaseWindow", "Math"))
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self.toolbar_edit.setWindowTitle(_translate("BaseWindow", "Math"))
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self.toolBar_nmr.setWindowTitle(_translate("BaseWindow", "NMR"))
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self.toolBar_nmr.setWindowTitle(_translate("BaseWindow", "NMR"))
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self.toolBar_fit.setWindowTitle(_translate("BaseWindow", "Fit"))
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self.toolBar_spectrum.setWindowTitle(_translate("BaseWindow", "Spectrum"))
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self.toolBar_spectrum.setWindowTitle(_translate("BaseWindow", "Spectrum"))
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self.toolBar_data.setWindowTitle(_translate("BaseWindow", "Data"))
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self.toolBar_data.setWindowTitle(_translate("BaseWindow", "Data"))
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self.action_close.setText(_translate("BaseWindow", "&Quit"))
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self.action_close.setText(_translate("BaseWindow", "&Quit"))
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@ -2,7 +2,7 @@
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# Form implementation generated from reading ui file 'src/resources/_ui/fitmodelwidget.ui'
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# Form implementation generated from reading ui file 'src/resources/_ui/fitmodelwidget.ui'
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#
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#
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# Created by: PyQt5 UI code generator 5.15.9
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# Created by: PyQt5 UI code generator 5.15.10
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#
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#
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# WARNING: Any manual changes made to this file will be lost when pyuic5 is
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# WARNING: Any manual changes made to this file will be lost when pyuic5 is
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# run again. Do not edit this file unless you know what you are doing.
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# run again. Do not edit this file unless you know what you are doing.
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@ -42,6 +42,7 @@ class Ui_FitParameter(object):
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(self.parameter_line.sizePolicy().hasHeightForWidth())
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sizePolicy.setHeightForWidth(self.parameter_line.sizePolicy().hasHeightForWidth())
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self.parameter_line.setSizePolicy(sizePolicy)
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self.parameter_line.setSizePolicy(sizePolicy)
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self.parameter_line.setMaximumSize(QtCore.QSize(160, 16777215))
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self.parameter_line.setText("")
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self.parameter_line.setText("")
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self.parameter_line.setObjectName("parameter_line")
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self.parameter_line.setObjectName("parameter_line")
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self.horizontalLayout_2.addWidget(self.parameter_line)
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self.horizontalLayout_2.addWidget(self.parameter_line)
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@ -51,6 +52,9 @@ class Ui_FitParameter(object):
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self.global_checkbox = QtWidgets.QCheckBox(FitParameter)
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self.global_checkbox = QtWidgets.QCheckBox(FitParameter)
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self.global_checkbox.setObjectName("global_checkbox")
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self.global_checkbox.setObjectName("global_checkbox")
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self.horizontalLayout_2.addWidget(self.global_checkbox)
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self.horizontalLayout_2.addWidget(self.global_checkbox)
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self.reset_button = QtWidgets.QPushButton(FitParameter)
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self.reset_button.setObjectName("reset_button")
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self.horizontalLayout_2.addWidget(self.reset_button)
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self.verticalLayout.addLayout(self.horizontalLayout_2)
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self.verticalLayout.addLayout(self.horizontalLayout_2)
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self.frame = QtWidgets.QFrame(FitParameter)
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self.frame = QtWidgets.QFrame(FitParameter)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Maximum, QtWidgets.QSizePolicy.Maximum)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Maximum, QtWidgets.QSizePolicy.Maximum)
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@ -82,6 +86,7 @@ class Ui_FitParameter(object):
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(self.lineEdit.sizePolicy().hasHeightForWidth())
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sizePolicy.setHeightForWidth(self.lineEdit.sizePolicy().hasHeightForWidth())
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self.lineEdit.setSizePolicy(sizePolicy)
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self.lineEdit.setSizePolicy(sizePolicy)
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self.lineEdit.setMaximumSize(QtCore.QSize(100, 16777215))
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self.lineEdit.setText("")
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self.lineEdit.setText("")
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self.lineEdit.setFrame(True)
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self.lineEdit.setFrame(True)
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self.lineEdit.setAlignment(QtCore.Qt.AlignLeading|QtCore.Qt.AlignLeft|QtCore.Qt.AlignVCenter)
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self.lineEdit.setAlignment(QtCore.Qt.AlignLeading|QtCore.Qt.AlignLeft|QtCore.Qt.AlignVCenter)
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@ -100,6 +105,7 @@ class Ui_FitParameter(object):
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(self.lineEdit_2.sizePolicy().hasHeightForWidth())
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sizePolicy.setHeightForWidth(self.lineEdit_2.sizePolicy().hasHeightForWidth())
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self.lineEdit_2.setSizePolicy(sizePolicy)
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self.lineEdit_2.setSizePolicy(sizePolicy)
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self.lineEdit_2.setMaximumSize(QtCore.QSize(100, 16777215))
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self.lineEdit_2.setText("")
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self.lineEdit_2.setText("")
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self.lineEdit_2.setFrame(True)
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self.lineEdit_2.setFrame(True)
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self.lineEdit_2.setObjectName("lineEdit_2")
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self.lineEdit_2.setObjectName("lineEdit_2")
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@ -122,6 +128,7 @@ class Ui_FitParameter(object):
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self.parameter_line.setPlaceholderText(_translate("FitParameter", "0"))
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self.parameter_line.setPlaceholderText(_translate("FitParameter", "0"))
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self.fixed_check.setText(_translate("FitParameter", "Fix"))
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self.fixed_check.setText(_translate("FitParameter", "Fix"))
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self.global_checkbox.setText(_translate("FitParameter", "Global"))
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self.global_checkbox.setText(_translate("FitParameter", "Global"))
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self.reset_button.setText(_translate("FitParameter", "Use global"))
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self.lineEdit.setToolTip(_translate("FitParameter", "<html><head/><body><p>Lower bound. Same bound is used for all data. Leave empty for no boundary condition.</p></body></html>"))
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self.lineEdit.setToolTip(_translate("FitParameter", "<html><head/><body><p>Lower bound. Same bound is used for all data. Leave empty for no boundary condition.</p></body></html>"))
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self.label_3.setText(_translate("FitParameter", "Textlabel"))
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self.label_3.setText(_translate("FitParameter", "Textlabel"))
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self.lineEdit_2.setToolTip(_translate("FitParameter", "<html><head/><body><p>Upper bound. Same bound is used for all data. Leave empty for no boundary condition.</p></body></html>"))
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self.lineEdit_2.setToolTip(_translate("FitParameter", "<html><head/><body><p>Upper bound. Same bound is used for all data. Leave empty for no boundary condition.</p></body></html>"))
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@ -1,138 +1,11 @@
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from __future__ import annotations
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from __future__ import annotations
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from nmreval.utils.text import convert
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from ..Qt import QtCore, QtWidgets, QtGui
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from ..Qt import QtCore, QtWidgets, QtGui
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from .._py.fitmodelwidget import Ui_FitParameter
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from .._py.save_fitmodel_dialog import Ui_SaveDialog
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from .._py.save_fitmodel_dialog import Ui_SaveDialog
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from ..lib.iconloading import get_icon
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from ..lib.iconloading import get_icon
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from ..lib.tables import TableWidget
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from ..lib.tables import TableWidget
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class FitModelWidget(QtWidgets.QWidget, Ui_FitParameter):
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"""
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Widget to show a global parameter
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"""
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value_requested = QtCore.pyqtSignal(object)
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value_changed = QtCore.pyqtSignal(str)
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state_changed = QtCore.pyqtSignal()
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replace_single_value = QtCore.pyqtSignal(object)
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def __init__(self, label: str = 'Fitparameter', parent=None, fixed: bool = False):
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super().__init__(parent)
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self.setupUi(self)
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self.name = label
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self.parametername.setText(convert(label) + ' ')
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self.parameter_line.setText('1')
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self.parameter_line.setMaximumWidth(160)
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self.lineEdit.setMaximumWidth(100)
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self.lineEdit_2.setMaximumWidth(100)
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self.label_3.setText(f'< {convert(label)} <')
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self.checkBox.stateChanged.connect(self.enableBounds)
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self.global_checkbox.stateChanged.connect(lambda: self.state_changed.emit())
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self.parameter_line.editingFinished.connect(self.update_parameter)
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self.parameter_line.values_requested.connect(lambda: self.value_requested.emit(self))
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self.parameter_line.replace_single_values.connect(lambda: self.replace_single_value.emit(None))
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self.parameter_line.editingFinished.connect(lambda: self.value_changed.emit(self.parameter_line.text()))
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self.fixed_check.toggled.connect(self.set_fixed)
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if fixed:
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self.fixed_check.hide()
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self.parameter_pos = None
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self.func_idx = None
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self._linetext = '1'
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self.menu = QtWidgets.QMenu(self)
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def set_parameter_string(self, p: str):
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self.parameter_line.setText(p)
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self.parameter_line.setToolTip(p)
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def set_bounds(self, lb: float, ub: float, cbox: bool = True):
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self.checkBox.setCheckState(QtCore.Qt.Checked if cbox else QtCore.Qt.Unchecked)
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for val, bds_line in [(lb, self.lineEdit), (ub, self.lineEdit_2)]:
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if val is not None:
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bds_line.setText(str(val))
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else:
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bds_line.setText('')
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def enableBounds(self, value: int):
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self.lineEdit.setEnabled(value == 2)
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self.lineEdit_2.setEnabled(value == 2)
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def set_parameter(self, p: float | None, bds: tuple[float, float, bool] = None,
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fixed: bool = None, glob: bool = None):
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ptext = f'{p:.4g}'
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self.set_parameter_string(ptext)
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if bds is not None:
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self.set_bounds(*bds)
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if fixed is not None:
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self.fixed_check.setCheckState(QtCore.Qt.CheckState.Unchecked if fixed else QtCore.Qt.CheckState.Checked)
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if glob is not None:
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self.global_checkbox.setCheckState(QtCore.Qt.CheckState.Checked if glob else QtCore.Qt.CheckState.Unchecked)
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def get_parameter(self):
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try:
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p = float(self.parameter_line.text().replace(',', '.'))
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except ValueError:
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p = self.parameter_line.text().replace(',', '.')
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if self.checkBox.isChecked():
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lb_text = self.lineEdit.text()
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lb = None
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if lb_text:
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try:
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lb = float(lb_text.replace(',', '.'))
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except ValueError:
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lb = lb_text
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ub_text = self.lineEdit_2.text()
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rb = None
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if ub_text:
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try:
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rb = float(ub_text.replace(',', '.'))
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except ValueError:
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rb = ub_text
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else:
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lb = rb = None
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bounds = (lb, rb)
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return p, bounds, not self.fixed_check.isChecked(), self.global_checkbox.isChecked()
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@QtCore.pyqtSlot(bool)
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def set_fixed(self, state: bool):
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# self.global_checkbox.setVisible(not state)
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self.frame.setVisible(not state)
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@QtCore.pyqtSlot()
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def update_parameter(self):
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new_value = self.parameter_line.text()
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if not new_value:
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self.parameter_line.setText('1')
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try:
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float(new_value)
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is_text = False
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except ValueError:
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is_text = True
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self.global_checkbox.setCheckState(False)
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self.set_fixed(is_text or self.fixed_check.isChecked())
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class QSaveModelDialog(QtWidgets.QDialog, Ui_SaveDialog):
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class QSaveModelDialog(QtWidgets.QDialog, Ui_SaveDialog):
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def __init__(self, types=None, parent=None):
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def __init__(self, types=None, parent=None):
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super().__init__(parent=parent)
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super().__init__(parent=parent)
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@ -172,30 +45,37 @@ class FitModelTree(QtWidgets.QTreeWidget):
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treeChanged = QtCore.pyqtSignal()
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treeChanged = QtCore.pyqtSignal()
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itemRemoved = QtCore.pyqtSignal(int)
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itemRemoved = QtCore.pyqtSignal(int)
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counterRole = QtCore.Qt.UserRole + 1
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counterRole = QtCore.Qt.ItemDataRole.UserRole + 1
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operatorRole = QtCore.Qt.UserRole + 2
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operatorRole = QtCore.Qt.ItemDataRole.UserRole + 2
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def __init__(self, parent=None):
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def __init__(self, parent=None):
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super().__init__(parent=parent)
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super().__init__(parent=parent)
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self.setHeaderHidden(True)
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self.setHeaderHidden(True)
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self.setDragEnabled(True)
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self.setDragEnabled(True)
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self.setDragDropMode(QtWidgets.QTreeWidget.InternalMove)
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self.setDragDropMode(QtWidgets.QTreeWidget.InternalMove)
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self.setDefaultDropAction(QtCore.Qt.MoveAction)
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self.setDefaultDropAction(QtCore.Qt.DropAction.MoveAction)
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self.itemSelectionChanged.connect(lambda: self.treeChanged.emit())
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self.itemSelectionChanged.connect(lambda: self.treeChanged.emit())
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def keyPressEvent(self, evt):
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def keyPressEvent(self, evt):
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operators = [QtCore.Qt.Key_Plus, QtCore.Qt.Key_Asterisk,
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operators = [
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QtCore.Qt.Key_Minus, QtCore.Qt.Key_Slash]
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QtCore.Qt.Key.Key_Plus,
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QtCore.Qt.Key.Key_Asterisk,
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QtCore.Qt.Key.Key_Minus,
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QtCore.Qt.Key.Key_Slash
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]
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if evt.key() == QtCore.Qt.Key_Delete:
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if evt.key() == QtCore.Qt.Key.Key_Delete:
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for item in self.selectedItems():
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for item in self.selectedItems():
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self.remove_function(item)
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self.remove_function(item)
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elif evt.key() == QtCore.Qt.Key_Space:
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elif evt.key() == QtCore.Qt.Key.Key_Space:
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for item in self.treeWidget.selectedItems():
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for item in self.treeWidget.selectedItems():
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item.setCheckState(0, QtCore.Qt.Checked) if item.checkState(
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cs = item.checkState(0)
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0) == QtCore.Qt.Unchecked else item.setCheckState(0, QtCore.Qt.Unchecked)
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if cs == QtCore.Qt.CheckState.Unchecked:
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item.setCheckState(0, QtCore.Qt.CheckState.Checked)
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else:
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item.setCheckState(0, QtCore.Qt.CheckState.Unchecked)
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elif evt.key() in operators:
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elif evt.key() in operators:
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idx = operators.index(evt.key())
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idx = operators.index(evt.key())
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@ -246,7 +126,7 @@ class FitModelTree(QtWidgets.QTreeWidget):
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color = QtGui.QColor(color)
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color = QtGui.QColor(color)
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it = QtWidgets.QTreeWidgetItem()
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it = QtWidgets.QTreeWidgetItem()
|
||||||
it.setData(0, QtCore.Qt.UserRole, idx)
|
it.setData(0, QtCore.Qt.ItemDataRole.UserRole, idx)
|
||||||
it.setData(0, self.counterRole, cnt)
|
it.setData(0, self.counterRole, cnt)
|
||||||
it.setData(0, self.operatorRole, op)
|
it.setData(0, self.operatorRole, op)
|
||||||
it.setText(0, name)
|
it.setText(0, name)
|
||||||
@ -257,7 +137,7 @@ class FitModelTree(QtWidgets.QTreeWidget):
|
|||||||
it.setForeground(0, QtGui.QBrush(color))
|
it.setForeground(0, QtGui.QBrush(color))
|
||||||
|
|
||||||
it.setIcon(0, get_icon(self.icons[op]))
|
it.setIcon(0, get_icon(self.icons[op]))
|
||||||
it.setCheckState(0, QtCore.Qt.Checked if active else QtCore.Qt.Unchecked)
|
it.setCheckState(0, QtCore.Qt.CheckState.Checked if active else QtCore.Qt.CheckState.Unchecked)
|
||||||
|
|
||||||
if parent is None:
|
if parent is None:
|
||||||
self.addTopLevelItem(it)
|
self.addTopLevelItem(it)
|
||||||
@ -277,7 +157,7 @@ class FitModelTree(QtWidgets.QTreeWidget):
|
|||||||
def get_selected(self):
|
def get_selected(self):
|
||||||
try:
|
try:
|
||||||
it = self.selectedItems()[0]
|
it = self.selectedItems()[0]
|
||||||
function_nr = it.data(0, QtCore.Qt.UserRole)
|
function_nr = it.data(0, QtCore.Qt.ItemDataRole.UserRole)
|
||||||
idx = it.data(0, self.counterRole)
|
idx = it.data(0, self.counterRole)
|
||||||
|
|
||||||
except IndexError:
|
except IndexError:
|
||||||
@ -300,10 +180,10 @@ class FitModelTree(QtWidgets.QTreeWidget):
|
|||||||
it = parent.child(i)
|
it = parent.child(i)
|
||||||
|
|
||||||
child = {
|
child = {
|
||||||
'idx': it.data(0, QtCore.Qt.UserRole),
|
'idx': it.data(0, QtCore.Qt.ItemDataRole.UserRole),
|
||||||
'op': it.data(0, self.operatorRole),
|
'op': it.data(0, self.operatorRole),
|
||||||
'pos': pos,
|
'pos': pos,
|
||||||
'active': (it.checkState(0) == QtCore.Qt.Checked),
|
'active': (it.checkState(0) == QtCore.Qt.CheckState.Checked),
|
||||||
'children': []
|
'children': []
|
||||||
}
|
}
|
||||||
|
|
||||||
@ -371,8 +251,8 @@ class FitTableWidget(TableWidget):
|
|||||||
|
|
||||||
for (sid, name) in set_ids:
|
for (sid, name) in set_ids:
|
||||||
item = QtWidgets.QTableWidgetItem(name)
|
item = QtWidgets.QTableWidgetItem(name)
|
||||||
item.setCheckState(QtCore.Qt.Checked)
|
item.setCheckState(QtCore.Qt.CheckState.Checked)
|
||||||
item.setData(QtCore.Qt.UserRole+1, sid)
|
item.setData(QtCore.Qt.ItemDataRole.UserRole+1, sid)
|
||||||
row = self.rowCount()
|
row = self.rowCount()
|
||||||
self.setRowCount(row+1)
|
self.setRowCount(row+1)
|
||||||
self.setItem(row, 0, item)
|
self.setItem(row, 0, item)
|
||||||
@ -390,15 +270,15 @@ class FitTableWidget(TableWidget):
|
|||||||
|
|
||||||
for i in range(self.rowCount()):
|
for i in range(self.rowCount()):
|
||||||
item = self.item(i, 0)
|
item = self.item(i, 0)
|
||||||
if item.checkState() == QtCore.Qt.Checked:
|
if item.checkState() == QtCore.Qt.CheckState.Checked:
|
||||||
mod = self.cellWidget(i, 1).currentData()
|
mod = self.cellWidget(i, 1).currentData()
|
||||||
if mod is None:
|
if mod is None:
|
||||||
mod = default
|
mod = default
|
||||||
|
|
||||||
if include_name:
|
if include_name:
|
||||||
arg = (item.data(QtCore.Qt.UserRole+1), item.text())
|
arg = (item.data(QtCore.Qt.ItemDataRole.UserRole+1), item.text())
|
||||||
else:
|
else:
|
||||||
arg = item.data(QtCore.Qt.UserRole+1)
|
arg = item.data(QtCore.Qt.ItemDataRole.UserRole+1)
|
||||||
|
|
||||||
if mod not in data:
|
if mod not in data:
|
||||||
data[mod] = []
|
data[mod] = []
|
||||||
@ -411,8 +291,8 @@ class FitTableWidget(TableWidget):
|
|||||||
for i in range(self.rowCount()):
|
for i in range(self.rowCount()):
|
||||||
item = self.item(i, 0)
|
item = self.item(i, 0)
|
||||||
if include_name:
|
if include_name:
|
||||||
ret_val.append((item.data(QtCore.Qt.UserRole+1), item.text()))
|
ret_val.append((item.data(QtCore.Qt.ItemDataRole.UserRole+1), item.text()))
|
||||||
else:
|
else:
|
||||||
ret_val.append(item.data(QtCore.Qt.UserRole+1))
|
ret_val.append(item.data(QtCore.Qt.ItemDataRole.UserRole+1))
|
||||||
|
|
||||||
return ret_val
|
return ret_val
|
||||||
|
@ -1,14 +1,12 @@
|
|||||||
from __future__ import annotations
|
from __future__ import annotations
|
||||||
|
|
||||||
from typing import Optional
|
|
||||||
|
|
||||||
from nmreval.fit.parameter import Parameter
|
from nmreval.fit.parameter import Parameter
|
||||||
from nmreval.utils.text import convert
|
from nmreval.utils.text import convert
|
||||||
|
|
||||||
from ..Qt import QtWidgets, QtCore, QtGui
|
from ..Qt import QtWidgets, QtCore, QtGui
|
||||||
from .._py.fitfuncwidget import Ui_FormFit
|
from .._py.fitfuncwidget import Ui_FormFit
|
||||||
|
from .._py.fitmodelwidget import Ui_FitParameter
|
||||||
from ..lib.forms import SelectionWidget
|
from ..lib.forms import SelectionWidget
|
||||||
from .fit_forms import FitModelWidget
|
|
||||||
|
|
||||||
|
|
||||||
class QFitParameterWidget(QtWidgets.QWidget, Ui_FormFit):
|
class QFitParameterWidget(QtWidgets.QWidget, Ui_FormFit):
|
||||||
@ -30,16 +28,15 @@ class QFitParameterWidget(QtWidgets.QWidget, Ui_FormFit):
|
|||||||
self.scrollwidget2.setLayout(QtWidgets.QVBoxLayout())
|
self.scrollwidget2.setLayout(QtWidgets.QVBoxLayout())
|
||||||
|
|
||||||
def eventFilter(self, src: QtCore.QObject, evt: QtCore.QEvent):
|
def eventFilter(self, src: QtCore.QObject, evt: QtCore.QEvent):
|
||||||
|
modifiers = QtCore.Qt.KeyboardModifier.ControlModifier | QtCore.Qt.KeyboardModifier.ShiftModifier
|
||||||
if isinstance(evt, QtGui.QKeyEvent):
|
if isinstance(evt, QtGui.QKeyEvent):
|
||||||
if (evt.key() == QtCore.Qt.Key_Right) and \
|
if (evt.key() == QtCore.Qt.Key.Key_Right) and (evt.modifiers() == modifiers):
|
||||||
(evt.modifiers() == QtCore.Qt.ControlModifier | QtCore.Qt.ShiftModifier):
|
|
||||||
self.change_single_parameter(src.value, sender=src)
|
self.change_single_parameter(src.value, sender=src)
|
||||||
self.select_next_preview(1)
|
self.select_next_preview(1)
|
||||||
|
|
||||||
return True
|
return True
|
||||||
|
|
||||||
elif (evt.key() == QtCore.Qt.Key_Left) and \
|
elif (evt.key() == QtCore.Qt.Key.Key_Left) and (evt.modifiers() == modifiers):
|
||||||
(evt.modifiers() == QtCore.Qt.ControlModifier | QtCore.Qt.ShiftModifier):
|
|
||||||
self.change_single_parameter(src.value, sender=src)
|
self.change_single_parameter(src.value, sender=src)
|
||||||
self.select_next_preview(-1)
|
self.select_next_preview(-1)
|
||||||
|
|
||||||
@ -65,7 +62,7 @@ class QFitParameterWidget(QtWidgets.QWidget, Ui_FormFit):
|
|||||||
self.glob_values = [1] * len(func.params)
|
self.glob_values = [1] * len(func.params)
|
||||||
|
|
||||||
for k, v in enumerate(func.params):
|
for k, v in enumerate(func.params):
|
||||||
widgt = FitModelWidget(label=v, parent=self.scrollwidget)
|
widgt = ParameterGlobalWidget(name=v, parent=self.scrollwidget)
|
||||||
widgt.parameter_pos = k
|
widgt.parameter_pos = k
|
||||||
widgt.func_idx = idx
|
widgt.func_idx = idx
|
||||||
try:
|
try:
|
||||||
@ -95,7 +92,7 @@ class QFitParameterWidget(QtWidgets.QWidget, Ui_FormFit):
|
|||||||
for w1, w2 in zip(self.global_parameter, self.data_parameter):
|
for w1, w2 in zip(self.global_parameter, self.data_parameter):
|
||||||
w1.parametername.setFixedSize(self.max_width)
|
w1.parametername.setFixedSize(self.max_width)
|
||||||
w1.checkBox.setFixedSize(self.max_width)
|
w1.checkBox.setFixedSize(self.max_width)
|
||||||
w2.label.setFixedSize(self.max_width)
|
w2.parametername.setFixedSize(self.max_width)
|
||||||
|
|
||||||
if hasattr(func, 'choices') and func.choices is not None:
|
if hasattr(func, 'choices') and func.choices is not None:
|
||||||
cbox = func.choices
|
cbox = func.choices
|
||||||
@ -175,7 +172,7 @@ class QFitParameterWidget(QtWidgets.QWidget, Ui_FormFit):
|
|||||||
# disable single parameter if it is set global, enable if global is unset
|
# disable single parameter if it is set global, enable if global is unset
|
||||||
widget = self.sender()
|
widget = self.sender()
|
||||||
idx = self.global_parameter.index(widget)
|
idx = self.global_parameter.index(widget)
|
||||||
enable = (widget.global_checkbox.checkState() == QtCore.Qt.Unchecked)
|
enable = (widget.global_checkbox.checkState() == QtCore.Qt.CheckState.Unchecked)
|
||||||
self.data_parameter[idx].setEnabled(enable)
|
self.data_parameter[idx].setEnabled(enable)
|
||||||
|
|
||||||
def select_next_preview(self, direction):
|
def select_next_preview(self, direction):
|
||||||
@ -215,7 +212,7 @@ class QFitParameterWidget(QtWidgets.QWidget, Ui_FormFit):
|
|||||||
param_general = []
|
param_general = []
|
||||||
|
|
||||||
for g in self.global_parameter:
|
for g in self.global_parameter:
|
||||||
if isinstance(g, FitModelWidget):
|
if isinstance(g, ParameterGlobalWidget):
|
||||||
p_i, bds_i, fixed_i, global_i = g.get_parameter()
|
p_i, bds_i, fixed_i, global_i = g.get_parameter()
|
||||||
parameter_i = Parameter(name=g.name, value=p_i, lb=bds_i[0], ub=bds_i[1], var=fixed_i)
|
parameter_i = Parameter(name=g.name, value=p_i, lb=bds_i[0], ub=bds_i[1], var=fixed_i)
|
||||||
param_general.append(parameter_i)
|
param_general.append(parameter_i)
|
||||||
@ -236,7 +233,7 @@ class QFitParameterWidget(QtWidgets.QWidget, Ui_FormFit):
|
|||||||
p = []
|
p = []
|
||||||
|
|
||||||
for i, (p_i, g) in enumerate(zip(parameter, self.global_parameter)):
|
for i, (p_i, g) in enumerate(zip(parameter, self.global_parameter)):
|
||||||
if isinstance(g, FitModelWidget):
|
if isinstance(g, ParameterGlobalWidget):
|
||||||
if (p_i is None) or is_global[i]:
|
if (p_i is None) or is_global[i]:
|
||||||
# set has no oen value
|
# set has no oen value
|
||||||
p.append(param_general[i].copy())
|
p.append(param_general[i].copy())
|
||||||
@ -303,8 +300,8 @@ class ParameterSingleWidget(QtWidgets.QWidget):
|
|||||||
self._init_ui()
|
self._init_ui()
|
||||||
|
|
||||||
self.name = name
|
self.name = name
|
||||||
self.label.setText(convert(name))
|
self.parametername.setText(convert(name))
|
||||||
self.label.setToolTip('If this is bold then this parameter is only for this data. '
|
self.parametername.setToolTip('If this is bold then this parameter is only for this data. '
|
||||||
'Otherwise, the general parameter is used and displayed')
|
'Otherwise, the general parameter is used and displayed')
|
||||||
|
|
||||||
# self.value_line.setValidator(QtGui.QDoubleValidator())
|
# self.value_line.setValidator(QtGui.QDoubleValidator())
|
||||||
@ -316,8 +313,8 @@ class ParameterSingleWidget(QtWidgets.QWidget):
|
|||||||
layout.setContentsMargins(2, 2, 2, 2)
|
layout.setContentsMargins(2, 2, 2, 2)
|
||||||
layout.setSpacing(2)
|
layout.setSpacing(2)
|
||||||
|
|
||||||
self.label = QtWidgets.QLabel(self)
|
self.parametername = QtWidgets.QLabel(self)
|
||||||
layout.addWidget(self.label)
|
layout.addWidget(self.parametername)
|
||||||
|
|
||||||
layout.addSpacerItem(QtWidgets.QSpacerItem(0, 0, QtWidgets.QSizePolicy.Expanding, QtWidgets.QSizePolicy.Minimum))
|
layout.addSpacerItem(QtWidgets.QSpacerItem(0, 0, QtWidgets.QSizePolicy.Expanding, QtWidgets.QSizePolicy.Minimum))
|
||||||
|
|
||||||
@ -347,6 +344,133 @@ class ParameterSingleWidget(QtWidgets.QWidget):
|
|||||||
|
|
||||||
def show_as_local_parameter(self, is_local: bool):
|
def show_as_local_parameter(self, is_local: bool):
|
||||||
if is_local:
|
if is_local:
|
||||||
self.label.setStyleSheet('font-weight: bold;')
|
self.parametername.setStyleSheet('font-weight: bold;')
|
||||||
else:
|
else:
|
||||||
self.label.setStyleSheet('')
|
self.parametername.setStyleSheet('')
|
||||||
|
|
||||||
|
|
||||||
|
class ParameterGlobalWidget(QtWidgets.QWidget, Ui_FitParameter):
|
||||||
|
"""
|
||||||
|
Widget to show a global parameter
|
||||||
|
"""
|
||||||
|
|
||||||
|
value_requested = QtCore.pyqtSignal(object)
|
||||||
|
value_changed = QtCore.pyqtSignal(str)
|
||||||
|
state_changed = QtCore.pyqtSignal()
|
||||||
|
replace_single_value = QtCore.pyqtSignal(object)
|
||||||
|
|
||||||
|
def __init__(self, name: str = 'Fitparameter', parent=None, fixed: bool = False):
|
||||||
|
super().__init__(parent)
|
||||||
|
self.setupUi(self)
|
||||||
|
|
||||||
|
self.name = name
|
||||||
|
self.reset_button.setVisible(False)
|
||||||
|
|
||||||
|
self.parametername.setText(convert(name) + ' ')
|
||||||
|
|
||||||
|
self.parameter_line.setText('1')
|
||||||
|
self.parameter_line.setMaximumWidth(160)
|
||||||
|
self.lineEdit.setMaximumWidth(100)
|
||||||
|
self.lineEdit_2.setMaximumWidth(100)
|
||||||
|
|
||||||
|
self.label_3.setText(f'< {convert(name)} <')
|
||||||
|
|
||||||
|
self.checkBox.stateChanged.connect(self.enableBounds)
|
||||||
|
self.global_checkbox.stateChanged.connect(lambda: self.state_changed.emit())
|
||||||
|
self.parameter_line.editingFinished.connect(self.update_parameter)
|
||||||
|
self.parameter_line.values_requested.connect(lambda: self.value_requested.emit(self))
|
||||||
|
self.parameter_line.replace_single_values.connect(lambda: self.replace_single_value.emit(None))
|
||||||
|
self.parameter_line.editingFinished.connect(lambda: self.value_changed.emit(self.parameter_line.text()))
|
||||||
|
self.fixed_check.toggled.connect(self.set_fixed)
|
||||||
|
|
||||||
|
if fixed:
|
||||||
|
self.fixed_check.hide()
|
||||||
|
|
||||||
|
self.reset_button.setVisible(False)
|
||||||
|
|
||||||
|
self.parameter_pos = None
|
||||||
|
self.func_idx = None
|
||||||
|
|
||||||
|
self._linetext = '1'
|
||||||
|
|
||||||
|
self.menu = QtWidgets.QMenu(self)
|
||||||
|
|
||||||
|
def set_parameter_string(self, p: str):
|
||||||
|
self.parameter_line.setText(p)
|
||||||
|
self.parameter_line.setToolTip(p)
|
||||||
|
|
||||||
|
def set_bounds(self, lb: float, ub: float, cbox: bool = True):
|
||||||
|
self.checkBox.setCheckState(QtCore.Qt.CheckState.Checked if cbox else QtCore.Qt.CheckState.Unchecked)
|
||||||
|
for val, bds_line in [(lb, self.lineEdit), (ub, self.lineEdit_2)]:
|
||||||
|
if val is not None:
|
||||||
|
bds_line.setText(str(val))
|
||||||
|
else:
|
||||||
|
bds_line.setText('')
|
||||||
|
|
||||||
|
def enableBounds(self, value: int):
|
||||||
|
self.lineEdit.setEnabled(value == 2)
|
||||||
|
self.lineEdit_2.setEnabled(value == 2)
|
||||||
|
|
||||||
|
def set_parameter(self, p: float | None, bds: tuple[float, float, bool] = None,
|
||||||
|
fixed: bool = None, glob: bool = None):
|
||||||
|
ptext = f'{p:.4g}'
|
||||||
|
|
||||||
|
self.set_parameter_string(ptext)
|
||||||
|
|
||||||
|
if bds is not None:
|
||||||
|
self.set_bounds(*bds)
|
||||||
|
|
||||||
|
if fixed is not None:
|
||||||
|
self.fixed_check.setCheckState(QtCore.Qt.CheckState.Unchecked if fixed else QtCore.Qt.CheckState.Checked)
|
||||||
|
|
||||||
|
if glob is not None:
|
||||||
|
self.global_checkbox.setCheckState(QtCore.Qt.CheckState.Checked if glob else QtCore.Qt.CheckState.Unchecked)
|
||||||
|
|
||||||
|
def get_parameter(self):
|
||||||
|
try:
|
||||||
|
p = float(self.parameter_line.text().replace(',', '.'))
|
||||||
|
except ValueError:
|
||||||
|
p = self.parameter_line.text().replace(',', '.')
|
||||||
|
|
||||||
|
if self.checkBox.isChecked():
|
||||||
|
lb_text = self.lineEdit.text()
|
||||||
|
lb = None
|
||||||
|
if lb_text:
|
||||||
|
try:
|
||||||
|
lb = float(lb_text.replace(',', '.'))
|
||||||
|
except ValueError:
|
||||||
|
lb = lb_text
|
||||||
|
|
||||||
|
ub_text = self.lineEdit_2.text()
|
||||||
|
rb = None
|
||||||
|
if ub_text:
|
||||||
|
try:
|
||||||
|
rb = float(ub_text.replace(',', '.'))
|
||||||
|
except ValueError:
|
||||||
|
rb = ub_text
|
||||||
|
else:
|
||||||
|
lb = rb = None
|
||||||
|
|
||||||
|
bounds = (lb, rb)
|
||||||
|
|
||||||
|
return p, bounds, not self.fixed_check.isChecked(), self.global_checkbox.isChecked()
|
||||||
|
|
||||||
|
@QtCore.pyqtSlot(bool)
|
||||||
|
def set_fixed(self, state: bool):
|
||||||
|
# self.global_checkbox.setVisible(not state)
|
||||||
|
self.frame.setVisible(not state)
|
||||||
|
|
||||||
|
@QtCore.pyqtSlot()
|
||||||
|
def update_parameter(self):
|
||||||
|
new_value = self.parameter_line.text()
|
||||||
|
if not new_value:
|
||||||
|
self.parameter_line.setText('1')
|
||||||
|
|
||||||
|
try:
|
||||||
|
float(new_value)
|
||||||
|
is_text = False
|
||||||
|
except ValueError:
|
||||||
|
is_text = True
|
||||||
|
self.global_checkbox.setCheckState(False)
|
||||||
|
|
||||||
|
self.set_fixed(is_text or self.fixed_check.isChecked())
|
||||||
|
97
src/gui_qt/fit/fit_toolbar.py
Normal file
97
src/gui_qt/fit/fit_toolbar.py
Normal file
@ -0,0 +1,97 @@
|
|||||||
|
from ..Qt import QtWidgets, QtGui, QtCore
|
||||||
|
from ..lib.iconloading import get_icon
|
||||||
|
from ..lib.pg_objects import RegionItem
|
||||||
|
|
||||||
|
|
||||||
|
class FitToolbar(QtWidgets.QToolBar):
|
||||||
|
def __init__(
|
||||||
|
self,
|
||||||
|
fitaction: QtWidgets.QAction,
|
||||||
|
limit_menu: QtWidgets.QMenu,
|
||||||
|
parent=None,
|
||||||
|
):
|
||||||
|
super().__init__(parent=parent)
|
||||||
|
|
||||||
|
self.fit_action = fitaction
|
||||||
|
self.region = RegionItem()
|
||||||
|
self.addAction(fitaction)
|
||||||
|
|
||||||
|
self.fitlim_button = QtWidgets.QToolButton(self)
|
||||||
|
self.fitlim_button.setMenu(limit_menu)
|
||||||
|
self.fitlim_button.setPopupMode(self.fitlim_button.InstantPopup)
|
||||||
|
self.fitlim_button.setIcon(get_icon('fit_region'))
|
||||||
|
self.addWidget(self.fitlim_button)
|
||||||
|
|
||||||
|
self.label = QtWidgets.QLabel(self)
|
||||||
|
self.label.setText('L: ')
|
||||||
|
self.addWidget(self.label)
|
||||||
|
self.label.setEnabled(False)
|
||||||
|
|
||||||
|
self.lineedit = QtWidgets.QLineEdit(self)
|
||||||
|
self.lineedit.setValidator(QtGui.QDoubleValidator())
|
||||||
|
self.lineedit.setMaximumWidth(92)
|
||||||
|
self.addWidget(self.lineedit)
|
||||||
|
self.lineedit.setEnabled(False)
|
||||||
|
|
||||||
|
self.label2 = QtWidgets.QLabel(self)
|
||||||
|
self.label2.setText(' R: ')
|
||||||
|
self.addWidget(self.label2)
|
||||||
|
self.label2.setEnabled(False)
|
||||||
|
|
||||||
|
self.lineedit2 = QtWidgets.QLineEdit(self)
|
||||||
|
self.lineedit2.setValidator(QtGui.QDoubleValidator())
|
||||||
|
self.addWidget(self.lineedit2)
|
||||||
|
self.lineedit2.setMaximumWidth(92)
|
||||||
|
self.lineedit2.setEnabled(False)
|
||||||
|
|
||||||
|
self.limit_group = QtWidgets.QActionGroup(self)
|
||||||
|
for ac in limit_menu.actions():
|
||||||
|
self.limit_group.addAction(ac)
|
||||||
|
|
||||||
|
self.limit_group.triggered.connect(self.change_limit_type)
|
||||||
|
|
||||||
|
self.region.sigRegionChanged.connect(self.change_labels)
|
||||||
|
self.change_labels()
|
||||||
|
|
||||||
|
self.lineedit.textChanged.connect(self.move_region)
|
||||||
|
self.lineedit2.textChanged.connect(self.move_region)
|
||||||
|
|
||||||
|
@QtCore.pyqtSlot(QtWidgets.QAction)
|
||||||
|
def change_limit_type(self, action: QtWidgets.QAction):
|
||||||
|
is_custom = (action.text() == 'Custom')
|
||||||
|
|
||||||
|
for w in [self.label, self.label2, self.lineedit, self.lineedit2]:
|
||||||
|
w.setEnabled(is_custom)
|
||||||
|
|
||||||
|
def change_labels(self):
|
||||||
|
r = self.region.getRegion()
|
||||||
|
self.lineedit.blockSignals(True)
|
||||||
|
self.lineedit.setText(f'{r[0]:.4g}')
|
||||||
|
self.lineedit.blockSignals(False)
|
||||||
|
|
||||||
|
self.lineedit2.blockSignals(True)
|
||||||
|
self.lineedit2.setText(f'{r[1]:.4g}')
|
||||||
|
self.lineedit2.blockSignals(False)
|
||||||
|
|
||||||
|
def move_region(self):
|
||||||
|
try:
|
||||||
|
r_min = float(self.lineedit.text())
|
||||||
|
except ValueError:
|
||||||
|
r_min = None
|
||||||
|
|
||||||
|
try:
|
||||||
|
r_max = float(self.lineedit2.text())
|
||||||
|
except ValueError:
|
||||||
|
r_max = None
|
||||||
|
|
||||||
|
if r_min is not None and r_max is not None:
|
||||||
|
self.region.setRegion((r_min, r_max), use_log=True)
|
||||||
|
|
||||||
|
def get_limit(self):
|
||||||
|
action_text = self.limit_group.checkedAction().text()
|
||||||
|
|
||||||
|
return {
|
||||||
|
'None': 'none',
|
||||||
|
'Visible x range': 'x',
|
||||||
|
'Custom': self.region.getRegion(),
|
||||||
|
}[action_text]
|
@ -165,7 +165,7 @@ class QFunctionWidget(QtWidgets.QWidget, Ui_Form):
|
|||||||
self.iscomplex = False
|
self.iscomplex = False
|
||||||
while iterator.value():
|
while iterator.value():
|
||||||
item = iterator.value()
|
item = iterator.value()
|
||||||
f = self.functions[item.data(0, QtCore.Qt.UserRole)]
|
f = self.functions[item.data(0, QtCore.Qt.ItemDataRole.UserRole)]
|
||||||
if hasattr(f, 'iscomplex') and f.iscomplex:
|
if hasattr(f, 'iscomplex') and f.iscomplex:
|
||||||
self.iscomplex = True
|
self.iscomplex = True
|
||||||
break
|
break
|
||||||
@ -226,7 +226,7 @@ class QFunctionWidget(QtWidgets.QWidget, Ui_Form):
|
|||||||
iterator = QtWidgets.QTreeWidgetItemIterator(self.functree)
|
iterator = QtWidgets.QTreeWidgetItemIterator(self.functree)
|
||||||
while iterator.value():
|
while iterator.value():
|
||||||
item = iterator.value()
|
item = iterator.value()
|
||||||
f = self.functions[item.data(0, QtCore.Qt.UserRole)]
|
f = self.functions[item.data(0, QtCore.Qt.ItemDataRole.UserRole)]
|
||||||
cnt = item.data(0, self.functree.counterRole)
|
cnt = item.data(0, self.functree.counterRole)
|
||||||
all_parameters[f'{f.name}_{cnt}'] = [(convert(pp, new='str'), (cnt, i)) for i, pp in enumerate(f.params)]
|
all_parameters[f'{f.name}_{cnt}'] = [(convert(pp, new='str'), (cnt, i)) for i, pp in enumerate(f.params)]
|
||||||
|
|
||||||
@ -240,7 +240,7 @@ class QFunctionWidget(QtWidgets.QWidget, Ui_Form):
|
|||||||
while iterator.value():
|
while iterator.value():
|
||||||
item = iterator.value()
|
item = iterator.value()
|
||||||
if item.checkState(0) != QtCore.Qt.CheckState.Unchecked:
|
if item.checkState(0) != QtCore.Qt.CheckState.Unchecked:
|
||||||
f = self.functions[item.data(0, QtCore.Qt.UserRole)]
|
f = self.functions[item.data(0, QtCore.Qt.ItemDataRole.UserRole)]
|
||||||
if hasattr(f, 'iscomplex') and f.iscomplex:
|
if hasattr(f, 'iscomplex') and f.iscomplex:
|
||||||
iscomplex = True
|
iscomplex = True
|
||||||
break
|
break
|
||||||
|
@ -9,7 +9,6 @@ import numpy as np
|
|||||||
from pyqtgraph import mkPen
|
from pyqtgraph import mkPen
|
||||||
|
|
||||||
from nmreval.fit._meta import MultiModel, ModelFactory
|
from nmreval.fit._meta import MultiModel, ModelFactory
|
||||||
from nmreval.fit.data import Data
|
|
||||||
from nmreval.fit.model import Model
|
from nmreval.fit.model import Model
|
||||||
from nmreval.fit.parameter import Parameters
|
from nmreval.fit.parameter import Parameters
|
||||||
from nmreval.fit.result import FitResult
|
from nmreval.fit.result import FitResult
|
||||||
@ -42,8 +41,8 @@ class QFitDialog(QtWidgets.QWidget, Ui_FitDialog):
|
|||||||
self._management = mgmt
|
self._management = mgmt
|
||||||
|
|
||||||
self._current_model = next(QFitDialog.model_cnt)
|
self._current_model = next(QFitDialog.model_cnt)
|
||||||
self.show_combobox.setItemData(0, self._current_model, QtCore.Qt.UserRole)
|
self.show_combobox.setItemData(0, self._current_model, QtCore.Qt.ItemDataRole.UserRole)
|
||||||
self.default_combobox.setItemData(0, self._current_model, QtCore.Qt.UserRole)
|
self.default_combobox.setItemData(0, self._current_model, QtCore.Qt.ItemDataRole.UserRole)
|
||||||
|
|
||||||
self.data_table = FitTableWidget(self.data_widget)
|
self.data_table = FitTableWidget(self.data_widget)
|
||||||
self.data_widget.addWidget(self.data_table)
|
self.data_widget.addWidget(self.data_table)
|
||||||
@ -150,9 +149,9 @@ class QFitDialog(QtWidgets.QWidget, Ui_FitDialog):
|
|||||||
|
|
||||||
# deselect all fit sets
|
# deselect all fit sets
|
||||||
for i in range(self.data_table.rowCount()):
|
for i in range(self.data_table.rowCount()):
|
||||||
data_id = self.data_table.item(i, 0).data(QtCore.Qt.UserRole+1)
|
data_id = self.data_table.item(i, 0).data(QtCore.Qt.ItemDataRole.UserRole+1)
|
||||||
if self._management[data_id].mode == 'fit' or self._management[data_id].has_relation(Relations.isFitPartOf):
|
if self._management[data_id].mode == 'fit' or self._management[data_id].has_relation(Relations.isFitPartOf):
|
||||||
self.data_table.item(i, 0).setCheckState(QtCore.Qt.Unchecked)
|
self.data_table.item(i, 0).setCheckState(QtCore.Qt.CheckState.Unchecked)
|
||||||
|
|
||||||
if self.models:
|
if self.models:
|
||||||
for m in self.models.keys():
|
for m in self.models.keys():
|
||||||
@ -176,7 +175,7 @@ class QFitDialog(QtWidgets.QWidget, Ui_FitDialog):
|
|||||||
|
|
||||||
self.default_combobox.addItem('Model '+idx, userData=idx)
|
self.default_combobox.addItem('Model '+idx, userData=idx)
|
||||||
self.show_combobox.addItem('Model '+idx, userData=idx)
|
self.show_combobox.addItem('Model '+idx, userData=idx)
|
||||||
self.show_combobox.setItemData(self.show_combobox.count()-1, idx, QtCore.Qt.UserRole)
|
self.show_combobox.setItemData(self.show_combobox.count()-1, idx, QtCore.Qt.ItemDataRole.UserRole)
|
||||||
self.show_combobox.setCurrentIndex(self.show_combobox.count()-1)
|
self.show_combobox.setCurrentIndex(self.show_combobox.count()-1)
|
||||||
|
|
||||||
self._current_model = idx
|
self._current_model = idx
|
||||||
@ -190,7 +189,7 @@ class QFitDialog(QtWidgets.QWidget, Ui_FitDialog):
|
|||||||
self.get_functions()
|
self.get_functions()
|
||||||
self.functionwidget.clear()
|
self.functionwidget.clear()
|
||||||
|
|
||||||
self._current_model = self.show_combobox.itemData(idx, QtCore.Qt.UserRole)
|
self._current_model = self.show_combobox.itemData(idx, QtCore.Qt.ItemDataRole.UserRole)
|
||||||
if self._current_model in self.models and len(self.models[self._current_model]):
|
if self._current_model in self.models and len(self.models[self._current_model]):
|
||||||
for el in self.models[self._current_model]:
|
for el in self.models[self._current_model]:
|
||||||
self.functionwidget.add_function(**el)
|
self.functionwidget.add_function(**el)
|
||||||
|
@ -217,8 +217,8 @@ class QFitResult(QtWidgets.QDialog, Ui_Dialog):
|
|||||||
|
|
||||||
if idx in self.graph_opts:
|
if idx in self.graph_opts:
|
||||||
view_range, logx, logy = self.graph_opts[idx]
|
view_range, logx, logy = self.graph_opts[idx]
|
||||||
self.fit_plot.setLogMode(x=logx, y=logy)
|
|
||||||
self.fit_plot.setRange(xRange=view_range[0], yRange=view_range[1], padding=0)
|
self.fit_plot.setRange(xRange=view_range[0], yRange=view_range[1], padding=0)
|
||||||
|
self.fit_plot.setLogMode(x=logx, y=logy)
|
||||||
self.logx_box.blockSignals(True)
|
self.logx_box.blockSignals(True)
|
||||||
self.logx_box.setChecked(logx)
|
self.logx_box.setChecked(logx)
|
||||||
self.logx_box.blockSignals(False)
|
self.logx_box.blockSignals(False)
|
||||||
|
@ -22,7 +22,8 @@ class Namespace:
|
|||||||
|
|
||||||
if basic:
|
if basic:
|
||||||
self.add_namespace(
|
self.add_namespace(
|
||||||
{'x': (None, 'x values'),
|
{
|
||||||
|
'x': (None, 'x values'),
|
||||||
'y': (None, 'x values'),
|
'y': (None, 'x values'),
|
||||||
'y_err': (None, 'y error values'),
|
'y_err': (None, 'y error values'),
|
||||||
'fit': (None, 'dictionary of fit parameter', 'fit["PIKA"]'),
|
'fit': (None, 'dictionary of fit parameter', 'fit["PIKA"]'),
|
||||||
@ -32,7 +33,8 @@ class Namespace:
|
|||||||
)
|
)
|
||||||
|
|
||||||
self.add_namespace(
|
self.add_namespace(
|
||||||
{'sin': (np.sin, 'Sine', 'sin(PIKA)'),
|
{
|
||||||
|
'sin': (np.sin, 'Sine', 'sin(PIKA)'),
|
||||||
'cos': (np.cos, 'Cosine', 'cos(PIKA)'),
|
'cos': (np.cos, 'Cosine', 'cos(PIKA)'),
|
||||||
'tan': (np.tan, 'Tangens', 'tan(PIKA)'),
|
'tan': (np.tan, 'Tangens', 'tan(PIKA)'),
|
||||||
'ln': (np.log, 'Natural Logarithm', 'ln(PIKA)'),
|
'ln': (np.log, 'Natural Logarithm', 'ln(PIKA)'),
|
||||||
@ -45,7 +47,8 @@ class Namespace:
|
|||||||
parents=('Basic', 'Functions'))
|
parents=('Basic', 'Functions'))
|
||||||
|
|
||||||
self.add_namespace(
|
self.add_namespace(
|
||||||
{'max': (np.max, 'Maximum value', 'max(PIKA)'),
|
{
|
||||||
|
'max': (np.max, 'Maximum value', 'max(PIKA)'),
|
||||||
'min': (np.min, 'Minimum value', 'min(PIKA)'),
|
'min': (np.min, 'Minimum value', 'min(PIKA)'),
|
||||||
'argmax': (np.argmax, 'Index of maximum value', 'argmax(PIKA)'),
|
'argmax': (np.argmax, 'Index of maximum value', 'argmax(PIKA)'),
|
||||||
'argmin': (np.argmax, 'Index of minimum value', 'argmin(PIKA)'),
|
'argmin': (np.argmax, 'Index of minimum value', 'argmin(PIKA)'),
|
||||||
@ -54,19 +57,24 @@ class Namespace:
|
|||||||
|
|
||||||
if const:
|
if const:
|
||||||
self.add_namespace(
|
self.add_namespace(
|
||||||
{'e': (constants.e, 'e / As'),
|
{
|
||||||
|
'e': (constants.e, 'e / As'),
|
||||||
'eps0': (constants.epsilon0, 'epsilon0 / As/Vm'),
|
'eps0': (constants.epsilon0, 'epsilon0 / As/Vm'),
|
||||||
'Eu': (constants.Eu,), 'h': (constants.h, 'h / eVs'),
|
'Eu': (constants.Eu,),
|
||||||
'hbar': (constants.hbar, 'hbar / eVs'), 'kB': (constants.kB, 'kB / eV/K'),
|
'h': (constants.h, 'h / eVs'),
|
||||||
'mu0': (constants.mu0, 'mu0 / Vs/Am'), 'NA': (constants.NA, 'NA / 1/mol'),
|
'hbar': (constants.hbar, 'hbar / eVs'),
|
||||||
'pi': (constants.pi,), 'R': (constants.R, 'R / eV'),
|
'kB': (constants.kB, 'kB / eV/K'),
|
||||||
|
'mu0': (constants.mu0, 'mu0 / Vs/Am'),
|
||||||
|
'NA': (constants.NA, 'NA / 1/mol'),
|
||||||
|
'pi': (constants.pi,),
|
||||||
|
'R': (constants.R, 'R / eV'),
|
||||||
},
|
},
|
||||||
parents=('Constants', 'Maybe useful'),
|
parents=('Constants', 'Maybe useful'),
|
||||||
)
|
)
|
||||||
|
|
||||||
self.add_namespace(
|
self.add_namespace(
|
||||||
{f'gamma["{k}"]': (v, k, f'gamma["{k}"]') for k, v in constants.gamma.items()},
|
{f'gamma["{k}"]': (v, k, f'gamma["{k}"]') for k, v in constants.gamma.items()},
|
||||||
parents=('Constants', 'Magnetogyric ratios (in 1/(sT))')
|
parents=('Constants', 'Gyromagnetic ratios (in 1/(sT))')
|
||||||
)
|
)
|
||||||
|
|
||||||
if fitfuncs:
|
if fitfuncs:
|
||||||
@ -199,7 +207,7 @@ class QNamespaceWidget(QtWidgets.QWidget, Ui_Form):
|
|||||||
|
|
||||||
for entry in subspace:
|
for entry in subspace:
|
||||||
key_item = QtWidgets.QTableWidgetItem(entry)
|
key_item = QtWidgets.QTableWidgetItem(entry)
|
||||||
key_item.setFlags(QtCore.Qt.ItemIsSelectable | QtCore.Qt.ItemIsEnabled)
|
key_item.setFlags(QtCore.Qt.ItemFlag.ItemIsSelectable | QtCore.Qt.ItemFlag.ItemIsEnabled)
|
||||||
|
|
||||||
vals = self.namespace.namespace[entry]
|
vals = self.namespace.namespace[entry]
|
||||||
|
|
||||||
@ -214,12 +222,12 @@ class QNamespaceWidget(QtWidgets.QWidget, Ui_Form):
|
|||||||
display = vals[1]
|
display = vals[1]
|
||||||
|
|
||||||
value_item = QtWidgets.QTableWidgetItem(display)
|
value_item = QtWidgets.QTableWidgetItem(display)
|
||||||
value_item.setFlags(QtCore.Qt.ItemIsSelectable | QtCore.Qt.ItemIsEnabled)
|
value_item.setFlags(QtCore.Qt.ItemFlag.ItemIsSelectable | QtCore.Qt.ItemFlag.ItemIsEnabled)
|
||||||
|
|
||||||
key_item.setData(QtCore.Qt.UserRole, alias)
|
key_item.setData(QtCore.Qt.ItemDataRole.UserRole, alias)
|
||||||
key_item.setData(QtCore.Qt.UserRole+1, entry)
|
key_item.setData(QtCore.Qt.ItemDataRole.UserRole+1, entry)
|
||||||
value_item.setData(QtCore.Qt.UserRole, alias)
|
value_item.setData(QtCore.Qt.ItemDataRole.UserRole, alias)
|
||||||
value_item.setData(QtCore.Qt.UserRole+1, entry)
|
value_item.setData(QtCore.Qt.ItemDataRole.UserRole+1, entry)
|
||||||
|
|
||||||
row = self.namespace_table.rowCount()
|
row = self.namespace_table.rowCount()
|
||||||
self.namespace_table.setRowCount(row+1)
|
self.namespace_table.setRowCount(row+1)
|
||||||
@ -241,5 +249,5 @@ class QNamespaceWidget(QtWidgets.QWidget, Ui_Form):
|
|||||||
|
|
||||||
@QtCore.pyqtSlot(QtWidgets.QTableWidgetItem, name='on_namespace_table_itemDoubleClicked')
|
@QtCore.pyqtSlot(QtWidgets.QTableWidgetItem, name='on_namespace_table_itemDoubleClicked')
|
||||||
def item_selected(self, item: QtWidgets.QTableWidgetItem):
|
def item_selected(self, item: QtWidgets.QTableWidgetItem):
|
||||||
self.selected.emit(item.data(QtCore.Qt.UserRole))
|
self.selected.emit(item.data(QtCore.Qt.ItemDataRole.UserRole))
|
||||||
self.sendKey.emit(item.data(QtCore.Qt.UserRole+1))
|
self.sendKey.emit(item.data(QtCore.Qt.ItemDataRole.UserRole+1))
|
||||||
|
@ -2,7 +2,6 @@ from __future__ import annotations
|
|||||||
|
|
||||||
import os
|
import os
|
||||||
import re
|
import re
|
||||||
import time
|
|
||||||
from pathlib import Path
|
from pathlib import Path
|
||||||
|
|
||||||
from numpy import geomspace, linspace
|
from numpy import geomspace, linspace
|
||||||
@ -17,13 +16,13 @@ from ..Qt import QtGui, QtPrintSupport
|
|||||||
from ..data.shift_graphs import QShift
|
from ..data.shift_graphs import QShift
|
||||||
from ..data.signaledit import QPreviewDialog, QBaselineDialog
|
from ..data.signaledit import QPreviewDialog, QBaselineDialog
|
||||||
from ..dsc.glass_dialog import TgCalculator
|
from ..dsc.glass_dialog import TgCalculator
|
||||||
|
from ..fit.fit_toolbar import FitToolbar
|
||||||
from ..fit.result import FitExtension, QFitResult
|
from ..fit.result import FitExtension, QFitResult
|
||||||
from ..graphs.graphwindow import QGraphWindow
|
from ..graphs.graphwindow import QGraphWindow
|
||||||
from ..graphs.movedialog import QMover
|
from ..graphs.movedialog import QMover
|
||||||
from ..io.fcbatchreader import QFCReader
|
from ..io.fcbatchreader import QFCReader
|
||||||
from ..io.filedialog import *
|
from ..io.filedialog import *
|
||||||
from ..lib.iconloading import make_action_icons, get_icon
|
from ..lib.iconloading import make_action_icons, get_icon
|
||||||
from ..lib.pg_objects import RegionItem
|
|
||||||
from ..lib.starter import make_starter
|
from ..lib.starter import make_starter
|
||||||
from ..math.binning import BinningWindow
|
from ..math.binning import BinningWindow
|
||||||
from ..math.evaluation import QEvalDialog
|
from ..math.evaluation import QEvalDialog
|
||||||
@ -97,12 +96,6 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
|||||||
self.norm_toolbutton.setIcon(get_icon('normal'))
|
self.norm_toolbutton.setIcon(get_icon('normal'))
|
||||||
self.toolbar_edit.addWidget(self.norm_toolbutton)
|
self.toolbar_edit.addWidget(self.norm_toolbutton)
|
||||||
|
|
||||||
self.fitlim_button = QtWidgets.QToolButton(self)
|
|
||||||
self.fitlim_button.setMenu(self.menuLimits)
|
|
||||||
self.fitlim_button.setPopupMode(self.fitlim_button.InstantPopup)
|
|
||||||
self.fitlim_button.setIcon(get_icon('fit_region'))
|
|
||||||
self.toolBar_fit.addWidget(self.fitlim_button)
|
|
||||||
|
|
||||||
while self.tabWidget.count() > 2:
|
while self.tabWidget.count() > 2:
|
||||||
self.tabWidget.removeTab(self.tabWidget.count()-1)
|
self.tabWidget.removeTab(self.tabWidget.count()-1)
|
||||||
|
|
||||||
@ -120,9 +113,11 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
|||||||
# noinspection PyUnresolvedReferences
|
# noinspection PyUnresolvedReferences
|
||||||
self.statusBar.addWidget(self.mousepos)
|
self.statusBar.addWidget(self.mousepos)
|
||||||
|
|
||||||
self.fitregion = RegionItem()
|
|
||||||
self._fit_plot_id = None
|
self._fit_plot_id = None
|
||||||
|
|
||||||
|
self.fit_toolbar = FitToolbar(self.action_FitWidget, self.menuLimits, self)
|
||||||
|
self.addToolBar(self.fit_toolbar)
|
||||||
|
|
||||||
self.setGeometry(QtWidgets.QStyle.alignedRect(
|
self.setGeometry(QtWidgets.QStyle.alignedRect(
|
||||||
QtCore.Qt.LayoutDirection.LeftToRight,
|
QtCore.Qt.LayoutDirection.LeftToRight,
|
||||||
QtCore.Qt.AlignmentFlag.AlignCenter,
|
QtCore.Qt.AlignmentFlag.AlignCenter,
|
||||||
@ -138,11 +133,6 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
|||||||
self.ac_group.addAction(self.action_nm_fit)
|
self.ac_group.addAction(self.action_nm_fit)
|
||||||
self.ac_group.addAction(self.action_odr_fit)
|
self.ac_group.addAction(self.action_odr_fit)
|
||||||
|
|
||||||
self.ac_group2 = QtWidgets.QActionGroup(self)
|
|
||||||
self.ac_group2.addAction(self.action_no_range)
|
|
||||||
self.ac_group2.addAction(self.action_x_range)
|
|
||||||
self.ac_group2.addAction(self.action_custom_range)
|
|
||||||
|
|
||||||
def _init_signals(self):
|
def _init_signals(self):
|
||||||
self.actionRedo = self.management.undostack.createRedoAction(self)
|
self.actionRedo = self.management.undostack.createRedoAction(self)
|
||||||
icon = QtGui.QIcon.fromTheme("edit-redo")
|
icon = QtGui.QIcon.fromTheme("edit-redo")
|
||||||
@ -158,7 +148,7 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
|||||||
|
|
||||||
self.action_save_fit_parameter.triggered.connect(self.save_fit_parameter)
|
self.action_save_fit_parameter.triggered.connect(self.save_fit_parameter)
|
||||||
# noinspection PyUnresolvedReferences
|
# noinspection PyUnresolvedReferences
|
||||||
self.ac_group2.triggered.connect(self.change_fit_limits)
|
self.fit_toolbar.limit_group.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(self.do_preview)
|
self.action_edit.triggered.connect(self.do_preview)
|
||||||
@ -899,29 +889,28 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
|||||||
for item in self.fit_dialog.preview_lines:
|
for item in self.fit_dialog.preview_lines:
|
||||||
self.current_graph_widget.add_external(item)
|
self.current_graph_widget.add_external(item)
|
||||||
if self.action_custom_range.isChecked():
|
if self.action_custom_range.isChecked():
|
||||||
self.current_graph_widget.add_external(self.fitregion)
|
self.current_graph_widget.add_external(self.fit_toolbar.region)
|
||||||
|
|
||||||
block_window = True
|
block_window = True
|
||||||
else:
|
else:
|
||||||
for item in self.fit_dialog.preview_lines:
|
for item in self.fit_dialog.preview_lines:
|
||||||
self.current_graph_widget.remove_external(item)
|
self.current_graph_widget.remove_external(item)
|
||||||
self.current_graph_widget.remove_external(self.fitregion)
|
self.current_graph_widget.remove_external(self.fit_toolbar.region)
|
||||||
|
|
||||||
return block_window
|
return block_window
|
||||||
|
|
||||||
@QtCore.pyqtSlot(QtWidgets.QAction)
|
@QtCore.pyqtSlot(QtWidgets.QAction)
|
||||||
def change_fit_limits(self, action: QtWidgets.QAction):
|
def change_fit_limits(self, action: QtWidgets.QAction):
|
||||||
|
if self.current_graph_widget is None:
|
||||||
|
return
|
||||||
|
|
||||||
if action == self.action_custom_range and self.fit_dialog.isVisible():
|
if action == self.action_custom_range and self.fit_dialog.isVisible():
|
||||||
self.current_graph_widget.add_external(self.fitregion)
|
self.current_graph_widget.add_external(self.fit_toolbar.region)
|
||||||
else:
|
else:
|
||||||
self.current_graph_widget.remove_external(self.fitregion)
|
self.current_graph_widget.remove_external(self.fit_toolbar.region)
|
||||||
|
|
||||||
def start_fit(self, parameter, links, fit_options):
|
def start_fit(self, parameter, links, fit_options):
|
||||||
fit_options['limits'] = {
|
fit_options['limits'] = self.fit_toolbar.get_limit()
|
||||||
self.action_no_range: 'none',
|
|
||||||
self.action_x_range: 'x',
|
|
||||||
self.action_custom_range: self.fitregion.getRegion()
|
|
||||||
}[self.ac_group2.checkedAction()]
|
|
||||||
|
|
||||||
fit_options['fit_mode'] = {
|
fit_options['fit_mode'] = {
|
||||||
self.action_lm_fit: 'lsq',
|
self.action_lm_fit: 'lsq',
|
||||||
|
@ -437,30 +437,6 @@
|
|||||||
<addaction name="t1action"/>
|
<addaction name="t1action"/>
|
||||||
<addaction name="actionCalculateT1"/>
|
<addaction name="actionCalculateT1"/>
|
||||||
</widget>
|
</widget>
|
||||||
<widget class="QToolBar" name="toolBar_fit">
|
|
||||||
<property name="sizePolicy">
|
|
||||||
<sizepolicy hsizetype="Fixed" vsizetype="Fixed">
|
|
||||||
<horstretch>0</horstretch>
|
|
||||||
<verstretch>0</verstretch>
|
|
||||||
</sizepolicy>
|
|
||||||
</property>
|
|
||||||
<property name="windowTitle">
|
|
||||||
<string>Fit</string>
|
|
||||||
</property>
|
|
||||||
<property name="iconSize">
|
|
||||||
<size>
|
|
||||||
<width>24</width>
|
|
||||||
<height>24</height>
|
|
||||||
</size>
|
|
||||||
</property>
|
|
||||||
<attribute name="toolBarArea">
|
|
||||||
<enum>TopToolBarArea</enum>
|
|
||||||
</attribute>
|
|
||||||
<attribute name="toolBarBreak">
|
|
||||||
<bool>false</bool>
|
|
||||||
</attribute>
|
|
||||||
<addaction name="action_FitWidget"/>
|
|
||||||
</widget>
|
|
||||||
<widget class="QToolBar" name="toolBar_spectrum">
|
<widget class="QToolBar" name="toolBar_spectrum">
|
||||||
<property name="sizePolicy">
|
<property name="sizePolicy">
|
||||||
<sizepolicy hsizetype="Preferred" vsizetype="Fixed">
|
<sizepolicy hsizetype="Preferred" vsizetype="Fixed">
|
||||||
|
@ -67,6 +67,12 @@
|
|||||||
<verstretch>0</verstretch>
|
<verstretch>0</verstretch>
|
||||||
</sizepolicy>
|
</sizepolicy>
|
||||||
</property>
|
</property>
|
||||||
|
<property name="maximumSize">
|
||||||
|
<size>
|
||||||
|
<width>160</width>
|
||||||
|
<height>16777215</height>
|
||||||
|
</size>
|
||||||
|
</property>
|
||||||
<property name="toolTip">
|
<property name="toolTip">
|
||||||
<string>Initial values</string>
|
<string>Initial values</string>
|
||||||
</property>
|
</property>
|
||||||
@ -92,6 +98,13 @@
|
|||||||
</property>
|
</property>
|
||||||
</widget>
|
</widget>
|
||||||
</item>
|
</item>
|
||||||
|
<item>
|
||||||
|
<widget class="QPushButton" name="reset_button">
|
||||||
|
<property name="text">
|
||||||
|
<string>Use global</string>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
</item>
|
||||||
</layout>
|
</layout>
|
||||||
</item>
|
</item>
|
||||||
<item>
|
<item>
|
||||||
@ -151,6 +164,12 @@
|
|||||||
<verstretch>0</verstretch>
|
<verstretch>0</verstretch>
|
||||||
</sizepolicy>
|
</sizepolicy>
|
||||||
</property>
|
</property>
|
||||||
|
<property name="maximumSize">
|
||||||
|
<size>
|
||||||
|
<width>100</width>
|
||||||
|
<height>16777215</height>
|
||||||
|
</size>
|
||||||
|
</property>
|
||||||
<property name="toolTip">
|
<property name="toolTip">
|
||||||
<string><html><head/><body><p>Lower bound. Same bound is used for all data. Leave empty for no boundary condition.</p></body></html></string>
|
<string><html><head/><body><p>Lower bound. Same bound is used for all data. Leave empty for no boundary condition.</p></body></html></string>
|
||||||
</property>
|
</property>
|
||||||
@ -195,6 +214,12 @@
|
|||||||
<verstretch>0</verstretch>
|
<verstretch>0</verstretch>
|
||||||
</sizepolicy>
|
</sizepolicy>
|
||||||
</property>
|
</property>
|
||||||
|
<property name="maximumSize">
|
||||||
|
<size>
|
||||||
|
<width>100</width>
|
||||||
|
<height>16777215</height>
|
||||||
|
</size>
|
||||||
|
</property>
|
||||||
<property name="toolTip">
|
<property name="toolTip">
|
||||||
<string><html><head/><body><p>Upper bound. Same bound is used for all data. Leave empty for no boundary condition.</p></body></html></string>
|
<string><html><head/><body><p>Upper bound. Same bound is used for all data. Leave empty for no boundary condition.</p></body></html></string>
|
||||||
</property>
|
</property>
|
||||||
|
Loading…
Reference in New Issue
Block a user