forked from IPKM/nmreval
Merge branch 'master' of ssh://chaos3.fkp.physik.tu-darmstadt.de/source/nmreval
This commit is contained in:
Markus Rosenstihl
commit
91d3f586c1
@ -1,10 +1,11 @@
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# -*- coding: utf-8 -*-
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# Form implementation generated from reading ui file '_ui/asciidialog.ui'
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# Form implementation generated from reading ui file '/autohome/dominik/nmreval/src/resources/_ui/asciidialog.ui'
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#
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# Created by: PyQt5 UI code generator 5.12.3
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# Created by: PyQt5 UI code generator 5.15.4
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#
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# WARNING! All changes made in this file will be lost!
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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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from PyQt5 import QtCore, QtGui, QtWidgets
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@ -23,11 +24,11 @@ class Ui_ascii_reader(object):
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self.verticalLayout_3 = QtWidgets.QVBoxLayout(self.tabWidgetPage1)
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self.verticalLayout_3.setContentsMargins(0, 0, 0, 0)
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self.verticalLayout_3.setObjectName("verticalLayout_3")
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self.plainTextEdit_2 = QtWidgets.QPlainTextEdit(self.tabWidgetPage1)
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self.plainTextEdit_2.setEnabled(False)
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self.plainTextEdit_2.setMaximumSize(QtCore.QSize(16777215, 180))
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self.plainTextEdit_2.setObjectName("plainTextEdit_2")
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self.verticalLayout_3.addWidget(self.plainTextEdit_2)
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self.comment_textfield = QtWidgets.QPlainTextEdit(self.tabWidgetPage1)
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self.comment_textfield.setEnabled(False)
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self.comment_textfield.setMaximumSize(QtCore.QSize(16777215, 180))
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self.comment_textfield.setObjectName("comment_textfield")
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self.verticalLayout_3.addWidget(self.comment_textfield)
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self.ascii_table = QtWidgets.QTableWidget(self.tabWidgetPage1)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Expanding, QtWidgets.QSizePolicy.Expanding)
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sizePolicy.setHorizontalStretch(0)
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@ -49,9 +50,9 @@ class Ui_ascii_reader(object):
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self.tabWidgetPage2.setObjectName("tabWidgetPage2")
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self.horizontalLayout_3 = QtWidgets.QHBoxLayout(self.tabWidgetPage2)
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self.horizontalLayout_3.setObjectName("horizontalLayout_3")
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self.plainTextEdit = QtWidgets.QPlainTextEdit(self.tabWidgetPage2)
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self.plainTextEdit.setObjectName("plainTextEdit")
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self.horizontalLayout_3.addWidget(self.plainTextEdit)
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self.delay_textfield = QtWidgets.QPlainTextEdit(self.tabWidgetPage2)
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self.delay_textfield.setObjectName("delay_textfield")
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self.horizontalLayout_3.addWidget(self.delay_textfield)
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self.formLayout = QtWidgets.QFormLayout()
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self.formLayout.setFieldGrowthPolicy(QtWidgets.QFormLayout.ExpandingFieldsGrow)
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self.formLayout.setContentsMargins(0, -1, -1, -1)
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@ -79,18 +80,18 @@ class Ui_ascii_reader(object):
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self.end_lineedit = QtWidgets.QLineEdit(self.tabWidgetPage2)
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self.end_lineedit.setObjectName("end_lineedit")
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self.formLayout.setWidget(2, QtWidgets.QFormLayout.FieldRole, self.end_lineedit)
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self.checkBox = QtWidgets.QCheckBox(self.tabWidgetPage2)
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self.checkBox.setLayoutDirection(QtCore.Qt.LeftToRight)
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self.checkBox.setObjectName("checkBox")
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self.formLayout.setWidget(3, QtWidgets.QFormLayout.SpanningRole, self.checkBox)
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self.checkBox_2 = QtWidgets.QCheckBox(self.tabWidgetPage2)
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self.log_checkBox = QtWidgets.QCheckBox(self.tabWidgetPage2)
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self.log_checkBox.setLayoutDirection(QtCore.Qt.LeftToRight)
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self.log_checkBox.setObjectName("log_checkBox")
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self.formLayout.setWidget(3, QtWidgets.QFormLayout.SpanningRole, self.log_checkBox)
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self.staggered_checkBox = QtWidgets.QCheckBox(self.tabWidgetPage2)
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sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Minimum, QtWidgets.QSizePolicy.Preferred)
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sizePolicy.setHorizontalStretch(0)
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sizePolicy.setVerticalStretch(0)
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sizePolicy.setHeightForWidth(self.checkBox_2.sizePolicy().hasHeightForWidth())
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self.checkBox_2.setSizePolicy(sizePolicy)
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self.checkBox_2.setObjectName("checkBox_2")
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self.formLayout.setWidget(4, QtWidgets.QFormLayout.LabelRole, self.checkBox_2)
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sizePolicy.setHeightForWidth(self.staggered_checkBox.sizePolicy().hasHeightForWidth())
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self.staggered_checkBox.setSizePolicy(sizePolicy)
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self.staggered_checkBox.setObjectName("staggered_checkBox")
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self.formLayout.setWidget(4, QtWidgets.QFormLayout.LabelRole, self.staggered_checkBox)
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self.stag_lineEdit = QtWidgets.QLineEdit(self.tabWidgetPage2)
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self.stag_lineEdit.setEnabled(True)
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self.stag_lineEdit.setObjectName("stag_lineEdit")
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@ -139,9 +140,9 @@ class Ui_ascii_reader(object):
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self.label_5 = QtWidgets.QLabel(self.widget)
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self.label_5.setObjectName("label_5")
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self.horizontalLayout_4.addWidget(self.label_5)
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self.lineEdit = QtWidgets.QLineEdit(self.widget)
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self.lineEdit.setObjectName("lineEdit")
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self.horizontalLayout_4.addWidget(self.lineEdit)
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self.deltay_lineEdit = QtWidgets.QLineEdit(self.widget)
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self.deltay_lineEdit.setObjectName("deltay_lineEdit")
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self.horizontalLayout_4.addWidget(self.deltay_lineEdit)
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self.horizontalLayout.addWidget(self.widget)
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self.verticalLayout.addLayout(self.horizontalLayout)
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self.horizontalLayout_2 = QtWidgets.QHBoxLayout()
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@ -152,23 +153,23 @@ class Ui_ascii_reader(object):
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self.horizontalLayout_2.addWidget(self.skippy_checkbox)
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spacerItem3 = QtWidgets.QSpacerItem(40, 20, QtWidgets.QSizePolicy.Expanding, QtWidgets.QSizePolicy.Minimum)
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self.horizontalLayout_2.addItem(spacerItem3)
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self.radioButton = QtWidgets.QRadioButton(ascii_reader)
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self.radioButton.setChecked(True)
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self.radioButton.setAutoExclusive(True)
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self.radioButton.setObjectName("radioButton")
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self.pts_radioButton = QtWidgets.QRadioButton(ascii_reader)
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self.pts_radioButton.setChecked(True)
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self.pts_radioButton.setAutoExclusive(True)
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self.pts_radioButton.setObjectName("pts_radioButton")
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self.buttonGroup = QtWidgets.QButtonGroup(ascii_reader)
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self.buttonGroup.setObjectName("buttonGroup")
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self.buttonGroup.addButton(self.radioButton)
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self.horizontalLayout_2.addWidget(self.radioButton)
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self.radioButton_2 = QtWidgets.QRadioButton(ascii_reader)
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self.radioButton_2.setAutoExclusive(True)
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self.radioButton_2.setObjectName("radioButton_2")
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self.buttonGroup.addButton(self.radioButton_2)
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self.horizontalLayout_2.addWidget(self.radioButton_2)
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self.radioButton_3 = QtWidgets.QRadioButton(ascii_reader)
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self.radioButton_3.setObjectName("radioButton_3")
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self.buttonGroup.addButton(self.radioButton_3)
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self.horizontalLayout_2.addWidget(self.radioButton_3)
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self.buttonGroup.addButton(self.pts_radioButton)
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self.horizontalLayout_2.addWidget(self.pts_radioButton)
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self.FID_radioButton = QtWidgets.QRadioButton(ascii_reader)
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self.FID_radioButton.setAutoExclusive(True)
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self.FID_radioButton.setObjectName("FID_radioButton")
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self.buttonGroup.addButton(self.FID_radioButton)
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self.horizontalLayout_2.addWidget(self.FID_radioButton)
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self.spectrum_radioButton = QtWidgets.QRadioButton(ascii_reader)
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self.spectrum_radioButton.setObjectName("spectrum_radioButton")
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self.buttonGroup.addButton(self.spectrum_radioButton)
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self.horizontalLayout_2.addWidget(self.spectrum_radioButton)
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self.verticalLayout.addLayout(self.horizontalLayout_2)
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self.buttonbox = QtWidgets.QDialogButtonBox(ascii_reader)
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self.buttonbox.setStandardButtons(QtWidgets.QDialogButtonBox.Apply|QtWidgets.QDialogButtonBox.Cancel|QtWidgets.QDialogButtonBox.Ok)
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@ -187,8 +188,8 @@ class Ui_ascii_reader(object):
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self.label_2.setText(_translate("ascii_reader", "Number of delays"))
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self.label_3.setText(_translate("ascii_reader", "Start value"))
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self.label_4.setText(_translate("ascii_reader", "End value"))
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self.checkBox.setText(_translate("ascii_reader", "Logarithmic scale"))
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self.checkBox_2.setText(_translate("ascii_reader", "Staggered range"))
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self.log_checkBox.setText(_translate("ascii_reader", "Logarithmic scale"))
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self.staggered_checkBox.setText(_translate("ascii_reader", "Staggered range"))
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self.pushButton.setText(_translate("ascii_reader", "Calculate delays"))
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self.tabWidget.setTabText(self.tabWidget.indexOf(self.tabWidgetPage2), _translate("ascii_reader", "Delays"))
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self.x_label.setText(_translate("ascii_reader", "x"))
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@ -198,6 +199,6 @@ class Ui_ascii_reader(object):
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self.label_5.setText(_translate("ascii_reader", "<html><head/><body><p>Δy</p></body></html>"))
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self.skippy_checkbox.setToolTip(_translate("ascii_reader", "Use selection for next files. Deletes possible delay values."))
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self.skippy_checkbox.setText(_translate("ascii_reader", "Skip next dialogues?"))
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self.radioButton.setText(_translate("ascii_reader", "Points"))
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self.radioButton_2.setText(_translate("ascii_reader", "FID"))
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self.radioButton_3.setText(_translate("ascii_reader", "Spectrum"))
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self.pts_radioButton.setText(_translate("ascii_reader", "Points"))
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self.FID_radioButton.setText(_translate("ascii_reader", "FID"))
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self.spectrum_radioButton.setText(_translate("ascii_reader", "Spectrum"))
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@ -2,7 +2,8 @@ from __future__ import annotations
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from typing import Any
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import numpy as np
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from numpy import ndarray, iscomplexobj, asarray
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from pyqtgraph import PlotDataItem
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from ..Qt import QtGui, QtCore, QtWidgets
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from .._py.valueeditor import Ui_MaskDialog
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@ -14,7 +15,7 @@ class ValueEditWidget(QtWidgets.QWidget, Ui_MaskDialog):
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itemChanged = QtCore.pyqtSignal(str, tuple, object)
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itemDeleted = QtCore.pyqtSignal(str, list)
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itemAdded = QtCore.pyqtSignal(str)
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values_selected = QtCore.pyqtSignal(str, list, list)
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values_selected = QtCore.pyqtSignal(str, str)
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split_signal = QtCore.pyqtSignal(str, int)
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def __init__(self, parent=None):
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@ -37,8 +38,10 @@ class ValueEditWidget(QtWidgets.QWidget, Ui_MaskDialog):
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self.tableView.setContextMenuPolicy(QtCore.Qt.CustomContextMenu)
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self.tableView.customContextMenuRequested.connect(self.ctx)
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self.graph_combobox.currentIndexChanged.connect(self._populate_sets)
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self.set_combobox.currentIndexChanged.connect(self._populate_table)
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self.selection_real = PlotDataItem(x=[], y=[], symbolSize=25, symbol='x',
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pen=None, symbolPen='#c9308e', symbolBrush='#c9308e')
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self.selection_imag = PlotDataItem(x=[], y=[], symbolSize=25, symbol='+',
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pen=None, symbolPen='#dcdcdc', symbolBrush='#dcdcdc')
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def __call__(self, items: dict):
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self.items = items
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@ -58,7 +61,7 @@ class ValueEditWidget(QtWidgets.QWidget, Ui_MaskDialog):
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return self
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@QtCore.pyqtSlot(int)
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@QtCore.pyqtSlot(int, name='on_graph_combobox_currentIndexChanged')
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def _populate_sets(self, idx: int):
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if idx == -1:
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self.graph_combobox.setCurrentIndex(0)
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@ -66,6 +69,7 @@ class ValueEditWidget(QtWidgets.QWidget, Ui_MaskDialog):
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self.set_combobox.blockSignals(True)
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self.set_combobox.clear()
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old_figure = self.connected_figure
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self.connected_figure = self.graph_combobox.currentData()
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if self.items:
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@ -80,13 +84,15 @@ class ValueEditWidget(QtWidgets.QWidget, Ui_MaskDialog):
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self.set_combobox.setCurrentIndex(sidx)
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self.set_combobox.currentIndexChanged.emit(sidx)
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@QtCore.pyqtSlot(int)
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self.values_selected.emit(old_figure, self.connected_figure)
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@QtCore.pyqtSlot(int, name='on_set_combobox_currentIndexChanged')
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def _populate_table(self, idx):
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self.selection_model.clearSelection()
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self.shown_set = self.set_combobox.itemData(idx)
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self.requestData.emit(self.set_combobox.itemData(idx))
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def set_data(self, data: list, mask: np.ndarray):
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def set_data(self, data: list, mask: ndarray):
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self.selection_model.clearSelection()
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self.model.loadData(data, mask)
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self.spinBox.setMaximum(self.model.rowCount())
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@ -193,9 +199,16 @@ class ValueEditWidget(QtWidgets.QWidget, Ui_MaskDialog):
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try:
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yvals.append(float(self.model.data(idx.sibling(idx.row(), 1))))
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except ValueError:
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yvals.append(complex(self.model.data(idx.sibling(idx.row(), 1))).real)
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yvals.append(complex(self.model.data(idx.sibling(idx.row(), 1))))
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self.values_selected.emit(self.connected_figure, xvals, yvals)
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yvals = asarray(yvals)
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if iscomplexobj(yvals):
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self.selection_real.setData(x=xvals, y=yvals.real)
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self.selection_imag.setData(x=xvals, y=yvals.imag)
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else:
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self.selection_real.setData(x=xvals, y=yvals)
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self.selection_imag.setData(x=[], y=[])
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@QtCore.pyqtSlot(name='on_toolButton_clicked')
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def goto(self):
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@ -227,7 +240,7 @@ class ValueModel(QtCore.QAbstractTableModel):
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def columnCount(self, *args, **kwargs) -> int:
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return len(self.headers)
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def loadData(self, data: list[np.ndarray], mask: np.ndarray):
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def loadData(self, data: list[ndarray], mask: ndarray):
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self.beginResetModel()
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self._data = []
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for x, y, y_err in zip(*data):
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@ -5,11 +5,13 @@ import os
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import uuid
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from math import isnan
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from pathlib import Path
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from numpy import errstate, floor, log10
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from pyqtgraph import GraphicsObject, getConfigOption, mkColor
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from nmreval.utils.text import convert
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from ..io.filedialog import FileDialog
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from ..lib.pg_objects import LegendItemBlock, RegionItem
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from ..Qt import QtCore, QtWidgets, QtGui
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@ -524,13 +526,16 @@ class QGraphWindow(QtWidgets.QGraphicsView, Ui_GraphWindow):
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str_format = imgformat.data().decode('utf-8')
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filters += ';;' + str_format.upper() + ' (*.' + str_format + ')'
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outfile, _ = QtWidgets.QFileDialog.getSaveFileName(self, caption='Export graphic', filter=filters,
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options=QtWidgets.QFileDialog.DontConfirmOverwrite)
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outfile = None
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f = FileDialog(caption='Export graphic', filters=filters)
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mode = f.exec()
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if mode == QtWidgets.QDialog.Accepted:
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outfile = f.save_file()
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if outfile:
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self.export(outfile)
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def export(self, outfile: str):
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_, suffix = os.path.splitext(outfile)
|
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def export(self, outfile: Path):
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suffix = outfile.suffix
|
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if suffix == '':
|
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QtWidgets.QMessageBox.warning(self, 'No file extension',
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'No file extension found, graphic was not saved.')
|
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@ -538,7 +543,7 @@ class QGraphWindow(QtWidgets.QGraphicsView, Ui_GraphWindow):
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if suffix == '.agr':
|
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res = 0
|
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if os.path.exists(outfile):
|
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if outfile.exists():
|
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res = GraceMsgBox(outfile, parent=self).exec()
|
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if res == -1:
|
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return
|
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@ -18,7 +18,7 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
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pal = QtWidgets.QApplication.instance().palette()
|
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rgb = pal.color(pal.Base).getRgb()[:3]
|
||||
rgb2 = pal.color(pal.Text).getRgb()[:3]
|
||||
self.plainTextEdit_2.setStyleSheet(f'QPlainTextEdit {{ background-color: rgb{rgb} ; color: rgb{rgb2}; }}')
|
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self.comment_textfield.setStyleSheet(f'Qdelay_textfield {{ background-color: rgb{rgb} ; color: rgb{rgb2}; }}')
|
||||
|
||||
self.ascii_table.horizontalHeader().setStretchLastSection(True)
|
||||
self.buttonbox.button(QtWidgets.QDialogButtonBox.Apply).clicked.connect(self.apply)
|
||||
@ -31,13 +31,12 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
||||
self.ascii_table.horizontalHeader().customContextMenuRequested.connect(self.ctx_table)
|
||||
|
||||
def __call__(self, fname, *args, **kwargs):
|
||||
|
||||
for i in [self.stag_lineEdit, self.start_lineedit, self.end_lineedit,
|
||||
self.plainTextEdit_2, self.ascii_table, self.delay_lineedit]:
|
||||
self.comment_textfield, self.ascii_table, self.delay_lineedit]:
|
||||
i.clear()
|
||||
self.checkBox_2.setChecked(False)
|
||||
self.checkBox.setChecked(False)
|
||||
self.plainTextEdit_2.show()
|
||||
self.staggered_checkBox.setChecked(False)
|
||||
self.log_checkBox.setChecked(False)
|
||||
self.comment_textfield.show()
|
||||
|
||||
self.reader = AsciiReader(fname)
|
||||
self.set_gui()
|
||||
@ -53,7 +52,7 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
||||
|
||||
def set_gui(self):
|
||||
for text in self.reader.header:
|
||||
self.plainTextEdit_2.appendPlainText(text)
|
||||
self.comment_textfield.appendPlainText(text)
|
||||
|
||||
self.ascii_table.setRowCount(self.reader.shape[0])
|
||||
self.ascii_table.setColumnCount(self.reader.shape[1])
|
||||
@ -62,7 +61,7 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
||||
if len(last_header_line) == self.reader.shape[1]:
|
||||
self.ascii_table.setHorizontalHeaderLabels(last_header_line)
|
||||
except IndexError:
|
||||
self.plainTextEdit_2.hide()
|
||||
self.comment_textfield.hide()
|
||||
|
||||
for i, line in enumerate(self.reader.data):
|
||||
for j, field in enumerate(line):
|
||||
@ -73,7 +72,7 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
||||
|
||||
if self.reader.delays is not None:
|
||||
set_string = ''.join(str(d) + '\n' for d in self.reader.delays)
|
||||
self.plainTextEdit.setPlainText(set_string)
|
||||
self.delay_textfield.setPlainText(set_string)
|
||||
self.delay_lineedit.setText(str(len(self.reader.delays)))
|
||||
|
||||
def ctx_table(self, _):
|
||||
@ -92,7 +91,7 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
||||
def set_columns(self, mode):
|
||||
cols = ' '.join([str(s.column()+1) for s in self.ascii_table.selectionModel().selectedColumns()])
|
||||
try:
|
||||
lineedit = {'x': self.x_lineedit, 'y': self.y_lineedit, 'yerr': self.lineEdit}[mode]
|
||||
lineedit = {'x': self.x_lineedit, 'y': self.y_lineedit, 'yerr': self.deltay_lineEdit}[mode]
|
||||
lineedit.setText(cols)
|
||||
except KeyError:
|
||||
pass
|
||||
@ -109,19 +108,19 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
||||
@QtCore.pyqtSlot(name='on_pushButton_clicked')
|
||||
def calc_delays(self):
|
||||
self.reader.calc_delays(float(self.start_lineedit.text()), float(self.end_lineedit.text()),
|
||||
int(self.delay_lineedit.text()), log=self.checkBox.isChecked(),
|
||||
stagg=self.checkBox_2.isChecked(), stag_size=int(self.stag_lineEdit.text()))
|
||||
int(self.delay_lineedit.text()), log=self.log_checkBox.isChecked(),
|
||||
stagg=self.staggered_checkBox.isChecked(), stag_size=int(self.stag_lineEdit.text()))
|
||||
|
||||
set_string = ''.join(str(d) + '\n' for d in self.reader.delays)
|
||||
self.plainTextEdit.setPlainText(set_string)
|
||||
self.delay_textfield.setPlainText(set_string)
|
||||
|
||||
def update_header(self, text, comment='#'):
|
||||
text = text.replace(comment, '').lstrip().rstrip()
|
||||
self.plainTextEdit_2.appendPlainText(text)
|
||||
self.comment_textfield.appendPlainText(text)
|
||||
|
||||
@QtCore.pyqtSlot()
|
||||
def on_plainTextEdit_textChanged(self):
|
||||
new_delays = str(self.plainTextEdit.toPlainText()).rstrip('\n').split('\n')
|
||||
def on_delay_textfield_textChanged(self):
|
||||
new_delays = str(self.delay_textfield.toPlainText()).rstrip('\n').split('\n')
|
||||
self.delay_lineedit.setText(str(len(new_delays)))
|
||||
if new_delays[0] == '':
|
||||
new_delays = None
|
||||
@ -150,7 +149,7 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
||||
except ValueError:
|
||||
y = None
|
||||
try:
|
||||
y_err = [int(t)-1 for t in str(self.lineEdit.text()).split(' ')]
|
||||
y_err = [int(t)-1 for t in str(self.deltay_lineEdit.text()).split(' ')]
|
||||
except ValueError:
|
||||
y_err = None
|
||||
|
||||
@ -179,7 +178,7 @@ class QAsciiReader(QtWidgets.QDialog, Ui_ascii_reader):
|
||||
if val == -2:
|
||||
self.widget.show()
|
||||
else:
|
||||
self.lineEdit.setText('')
|
||||
self.deltay_lineEdit.setText('')
|
||||
self.widget.hide()
|
||||
|
||||
@QtCore.pyqtSlot(int, name='on_skippy_checkbox_stateChanged')
|
||||
|
||||
@ -1,5 +1,7 @@
|
||||
from __future__ import annotations
|
||||
|
||||
from pathlib import Path
|
||||
|
||||
from numpy import c_
|
||||
|
||||
from nmreval.io.graceeditor import GraceEditor
|
||||
@ -13,7 +15,7 @@ class GraceExporter:
|
||||
self.__agr = None
|
||||
self.__opts = kwargs
|
||||
|
||||
def export(self, outfile: str, mode: int | str = 'w'):
|
||||
def export(self, outfile: str | Path, mode: int | str = 'w'):
|
||||
if mode == 'w':
|
||||
self.__agr = GraceEditor()
|
||||
else:
|
||||
|
||||
@ -5,13 +5,16 @@ import pathlib
|
||||
from ..Qt import QtWidgets, QtCore
|
||||
|
||||
|
||||
class _FileDialog(QtWidgets.QFileDialog):
|
||||
class FileDialog(QtWidgets.QFileDialog):
|
||||
last_path = None
|
||||
|
||||
def __init__(self, directory=None, caption=None, filters='', parent=None):
|
||||
super().__init__(parent=parent)
|
||||
|
||||
self.setOption(QtWidgets.QFileDialog.DontUseNativeDialog, True)
|
||||
|
||||
self.setWindowTitle(caption)
|
||||
if directory is not None:
|
||||
self.setDirectory(str(directory))
|
||||
self.setNameFilters(filters.split(';;'))
|
||||
|
||||
@ -29,8 +32,14 @@ class _FileDialog(QtWidgets.QFileDialog):
|
||||
line.setFrameShadow(line.Sunken)
|
||||
self.layout().addWidget(line, self.layout().rowCount(), 0, 1, self.layout().columnCount())
|
||||
|
||||
def save_file(self) -> pathlib.Path | None:
|
||||
outfile = self.selectedFiles()
|
||||
if outfile:
|
||||
return pathlib.Path(outfile[0])
|
||||
return
|
||||
|
||||
class OpenFileDialog(_FileDialog):
|
||||
|
||||
class OpenFileDialog(FileDialog):
|
||||
def __init__(self, directory=None, caption=None, filters='', parent=None):
|
||||
super().__init__(directory=directory, caption=caption, filters=filters, parent=parent)
|
||||
|
||||
@ -71,7 +80,7 @@ class OpenFileDialog(_FileDialog):
|
||||
self.add_to_graph = self.comboBox.itemData(idx)
|
||||
|
||||
|
||||
class SaveDirectoryDialog(_FileDialog):
|
||||
class SaveDirectoryDialog(FileDialog):
|
||||
def __init__(self, directory=None, filters='', parent=None):
|
||||
super().__init__(directory=directory, filters=filters, parent=parent)
|
||||
|
||||
@ -115,8 +124,3 @@ class SaveDirectoryDialog(_FileDialog):
|
||||
self.setNameFilters(['All files (*.*)', 'Session file (*.nmr)', 'Text file (*.dat)',
|
||||
'HDF file (*.h5)', 'Grace files (*.agr)'])
|
||||
|
||||
def save_file(self) -> pathlib.Path | None:
|
||||
outfile = self.selectedFiles()
|
||||
if outfile:
|
||||
return pathlib.Path(outfile[0])
|
||||
return
|
||||
|
||||
@ -101,9 +101,6 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
||||
self.statusBar.addWidget(self.mousepos)
|
||||
|
||||
self.fitregion = RegionItem()
|
||||
self._values_plot = PlotDataItem(x=[], y=[], symbolSize=30, symbol='x',
|
||||
pen=None, symbolPen='#d526b5', symbolBrush='#d526b5')
|
||||
|
||||
self._fit_plot_id = None
|
||||
|
||||
self.setGeometry(QtWidgets.QStyle.alignedRect(QtCore.Qt.LeftToRight, QtCore.Qt.AlignCenter,
|
||||
@ -530,12 +527,14 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
||||
def _select_valuewidget(self, onoff: bool):
|
||||
if onoff: # Values
|
||||
self.valuewidget(self.management.graphs.tree())
|
||||
self.valuewidget.connected_figure = self.management.current_graph
|
||||
if self.valuewidget.connected_figure is not None:
|
||||
self.management.graphs[self.valuewidget.connected_figure].add_external(self._values_plot)
|
||||
current_graph = self.valuewidget.connected_figure
|
||||
if current_graph is not None:
|
||||
self.management.graphs[current_graph].add_external(self.valuewidget.selection_real)
|
||||
self.management.graphs[current_graph].add_external(self.valuewidget.selection_imag)
|
||||
else:
|
||||
if self.valuewidget.connected_figure is not None:
|
||||
self.management.graphs[self.valuewidget.connected_figure].remove_external(self._values_plot)
|
||||
self.management.graphs[self.valuewidget.connected_figure].remove_external(self.valuewidget.selection_real)
|
||||
self.management.graphs[self.valuewidget.connected_figure].remove_external(self.valuewidget.selection_imag)
|
||||
|
||||
def _select_integralwidget(self, onoff: bool, pick_required: bool, block_window: bool) -> tuple[bool, bool]:
|
||||
if self.current_graph_widget is None:
|
||||
@ -777,12 +776,12 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
|
||||
data, mask = self.management.get_data(sid)
|
||||
self.valuewidget.set_data(data, mask)
|
||||
|
||||
def plot_selected_values(self, gid: str, x: list, y: list):
|
||||
self._values_plot.setData(x=x, y=y)
|
||||
if gid != self.valuewidget.connected_figure and self.valuewidget.connected_figure is not None:
|
||||
self.management.graphs[self.valuewidget.connected_figure].remove_external(self._values_plot)
|
||||
self.management.graphs[gid].add_external(self._values_plot)
|
||||
self.valuewidget.connected_figure = gid
|
||||
def plot_selected_values(self, old_gid: str, new_gid: str):
|
||||
for pts in (self.valuewidget.selection_real, self.valuewidget.selection_imag):
|
||||
if old_gid:
|
||||
self.management.graphs[old_gid].remove_external(pts)
|
||||
if new_gid:
|
||||
self.management.graphs[new_gid].add_external(pts)
|
||||
|
||||
@QtCore.pyqtSlot(object, str)
|
||||
def item_to_graph(self, item, graph_id):
|
||||
|
||||
@ -9,12 +9,13 @@ from nmreval.fit import data as fit_d
|
||||
from nmreval.fit.model import Model
|
||||
from nmreval.fit.result import FitResult
|
||||
from nmreval.fit.minimizer import FitRoutine
|
||||
from nmreval.lib.colors import TUColorsC, available_cycles
|
||||
from nmreval.lib.colors import available_cycles
|
||||
from nmreval.math.interpol import interpolate
|
||||
from nmreval.math.logfourier import logft
|
||||
from nmreval.math.smooth import smooth
|
||||
from nmreval.nmr.relaxation import Relaxation
|
||||
|
||||
from ..Qt import QtCore, QtWidgets
|
||||
from ..lib.undos import *
|
||||
from ..data.container import *
|
||||
from ..io.filereaders import QFileReader
|
||||
@ -112,6 +113,8 @@ class UpperManagement(QtCore.QObject):
|
||||
self.undostack = QtWidgets.QUndoStack()
|
||||
self.deleteData.connect(self.plot_from_graph)
|
||||
|
||||
self._filereader = None
|
||||
|
||||
def __setitem__(self, key: str, value, **kwargs):
|
||||
if isinstance(value, ExperimentContainer):
|
||||
item = value
|
||||
@ -148,7 +151,9 @@ class UpperManagement(QtCore.QObject):
|
||||
return _id
|
||||
|
||||
def load_files(self, fname: List[str], new_plot: str = None):
|
||||
ret_dic = QFileReader(manager=self).readfiles(fname)
|
||||
if self._filereader is None:
|
||||
self._filereader = QFileReader(manager=self)
|
||||
ret_dic = self._filereader.readfiles(fname)
|
||||
self.add_new_data(ret_dic, new_plot)
|
||||
|
||||
def _load_session(self, sets: dict, graphs: dict):
|
||||
@ -1000,9 +1005,9 @@ class UpperManagement(QtCore.QObject):
|
||||
if opts['axis1'] in ['t', 'invt1000']:
|
||||
t_p = opts['t_param']
|
||||
if len(t_p) == 2:
|
||||
from ...models import Arrhenius as Func
|
||||
from nmreval.models import Arrhenius as Func
|
||||
else:
|
||||
from ...models import VFT as Func
|
||||
from nmreval.models import VFT as Func
|
||||
|
||||
_x = Func.func(x1, *t_p, invt=opts['axis1'])
|
||||
|
||||
@ -1078,7 +1083,7 @@ class UpperManagement(QtCore.QObject):
|
||||
raise ValueError('No file extension detected')
|
||||
|
||||
if suffix == '.nmr':
|
||||
from ...io.sessionwriter import NMRWriter
|
||||
from nmreval.io.sessionwriter import NMRWriter
|
||||
NMRWriter(self.graphs, self.data).export(path)
|
||||
|
||||
return
|
||||
|
||||
@ -105,6 +105,7 @@ class AsciiReader:
|
||||
|
||||
if mode == 'Points':
|
||||
try:
|
||||
# TODO read errors correctly
|
||||
for k in range(1, raw_data.shape[2]):
|
||||
if raw_data.shape[2] < 3:
|
||||
name = only_f
|
||||
|
||||
@ -1,3 +1,5 @@
|
||||
from __future__ import annotations
|
||||
|
||||
import pathlib
|
||||
import re
|
||||
from io import StringIO
|
||||
@ -93,7 +95,7 @@ class GraceEditor:
|
||||
|
||||
return s
|
||||
|
||||
def parse(self, filename):
|
||||
def parse(self, filename: str | pathlib.Path):
|
||||
self.file = pathlib.Path(filename)
|
||||
|
||||
# we start always with the header
|
||||
|
||||
@ -24,11 +24,20 @@
|
||||
<string>Data</string>
|
||||
</attribute>
|
||||
<layout class="QVBoxLayout" name="verticalLayout_3">
|
||||
<property name="margin">
|
||||
<property name="leftMargin">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<property name="topMargin">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<property name="rightMargin">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<property name="bottomMargin">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<item>
|
||||
<widget class="QPlainTextEdit" name="plainTextEdit_2">
|
||||
<widget class="QPlainTextEdit" name="comment_textfield">
|
||||
<property name="enabled">
|
||||
<bool>false</bool>
|
||||
</property>
|
||||
@ -76,7 +85,7 @@
|
||||
</attribute>
|
||||
<layout class="QHBoxLayout" name="horizontalLayout_3">
|
||||
<item>
|
||||
<widget class="QPlainTextEdit" name="plainTextEdit"/>
|
||||
<widget class="QPlainTextEdit" name="delay_textfield"/>
|
||||
</item>
|
||||
<item>
|
||||
<layout class="QFormLayout" name="formLayout">
|
||||
@ -123,7 +132,7 @@
|
||||
<widget class="QLineEdit" name="end_lineedit"/>
|
||||
</item>
|
||||
<item row="3" column="0" colspan="2">
|
||||
<widget class="QCheckBox" name="checkBox">
|
||||
<widget class="QCheckBox" name="log_checkBox">
|
||||
<property name="layoutDirection">
|
||||
<enum>Qt::LeftToRight</enum>
|
||||
</property>
|
||||
@ -133,7 +142,7 @@
|
||||
</widget>
|
||||
</item>
|
||||
<item row="4" column="0">
|
||||
<widget class="QCheckBox" name="checkBox_2">
|
||||
<widget class="QCheckBox" name="staggered_checkBox">
|
||||
<property name="sizePolicy">
|
||||
<sizepolicy hsizetype="Minimum" vsizetype="Preferred">
|
||||
<horstretch>0</horstretch>
|
||||
@ -243,7 +252,16 @@
|
||||
<property name="spacing">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<property name="margin">
|
||||
<property name="leftMargin">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<property name="topMargin">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<property name="rightMargin">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<property name="bottomMargin">
|
||||
<number>0</number>
|
||||
</property>
|
||||
<item>
|
||||
@ -267,7 +285,7 @@
|
||||
</widget>
|
||||
</item>
|
||||
<item>
|
||||
<widget class="QLineEdit" name="lineEdit"/>
|
||||
<widget class="QLineEdit" name="deltay_lineEdit"/>
|
||||
</item>
|
||||
</layout>
|
||||
</widget>
|
||||
@ -303,7 +321,7 @@
|
||||
</spacer>
|
||||
</item>
|
||||
<item>
|
||||
<widget class="QRadioButton" name="radioButton">
|
||||
<widget class="QRadioButton" name="pts_radioButton">
|
||||
<property name="text">
|
||||
<string>Points</string>
|
||||
</property>
|
||||
@ -319,7 +337,7 @@
|
||||
</widget>
|
||||
</item>
|
||||
<item>
|
||||
<widget class="QRadioButton" name="radioButton_2">
|
||||
<widget class="QRadioButton" name="FID_radioButton">
|
||||
<property name="text">
|
||||
<string>FID</string>
|
||||
</property>
|
||||
@ -332,7 +350,7 @@
|
||||
</widget>
|
||||
</item>
|
||||
<item>
|
||||
<widget class="QRadioButton" name="radioButton_3">
|
||||
<widget class="QRadioButton" name="spectrum_radioButton">
|
||||
<property name="text">
|
||||
<string>Spectrum</string>
|
||||
</property>
|
||||
|
||||
Loading…
Reference in New Issue
Block a user