add hodge fit

src/gui_qt/_py/tnmh_dialog.py

@@ -14,7 +14,7 @@ from PyQt5 import QtCore, QtGui, QtWidgets
 class Ui_Dialog(object):
     def setupUi(self, Dialog):
         Dialog.setObjectName("Dialog")
-        Dialog.resize(1041, 773)
+        Dialog.resize(1094, 829)
         self.gridLayout = QtWidgets.QGridLayout(Dialog)
         self.gridLayout.setObjectName("gridLayout")
         self.buttonBox = QtWidgets.QDialogButtonBox(Dialog)
@@ -61,27 +61,30 @@ class Ui_Dialog(object):
         self.dsc_plot.setSizePolicy(sizePolicy)
         self.dsc_plot.setObjectName("dsc_plot")
         self.gridLayout.addWidget(self.dsc_plot, 0, 1, 1, 1)
-        self.horizontalLayout_2 = QtWidgets.QHBoxLayout()
+        self.verticalLayout_2 = QtWidgets.QVBoxLayout()
-        self.horizontalLayout_2.setObjectName("horizontalLayout_2")
+        self.verticalLayout_2.setObjectName("verticalLayout_2")
-        self.calctg_button = QtWidgets.QPushButton(Dialog)
+        self.calctg_button = QtWidgets.QToolButton(Dialog)
-        sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Maximum, QtWidgets.QSizePolicy.Fixed)
+        sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Preferred, QtWidgets.QSizePolicy.Preferred)
         sizePolicy.setHorizontalStretch(0)
         sizePolicy.setVerticalStretch(0)
         sizePolicy.setHeightForWidth(self.calctg_button.sizePolicy().hasHeightForWidth())
         self.calctg_button.setSizePolicy(sizePolicy)
+        self.calctg_button.setToolButtonStyle(QtCore.Qt.ToolButtonTextBesideIcon)
+        self.calctg_button.setArrowType(QtCore.Qt.RightArrow)
         self.calctg_button.setObjectName("calctg_button")
-        self.horizontalLayout_2.addWidget(self.calctg_button)
+        self.verticalLayout_2.addWidget(self.calctg_button)
-        self.pushButton_2 = QtWidgets.QPushButton(Dialog)
+        self.toolButton_2 = QtWidgets.QToolButton(Dialog)
-        sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Maximum, QtWidgets.QSizePolicy.Fixed)
+        sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Maximum, QtWidgets.QSizePolicy.Preferred)
         sizePolicy.setHorizontalStretch(0)
         sizePolicy.setVerticalStretch(0)
-        sizePolicy.setHeightForWidth(self.pushButton_2.sizePolicy().hasHeightForWidth())
+        sizePolicy.setHeightForWidth(self.toolButton_2.sizePolicy().hasHeightForWidth())
-        self.pushButton_2.setSizePolicy(sizePolicy)
+        self.toolButton_2.setSizePolicy(sizePolicy)
-        self.pushButton_2.setObjectName("pushButton_2")
+        self.toolButton_2.setToolButtonStyle(QtCore.Qt.ToolButtonTextBesideIcon)
-        self.horizontalLayout_2.addWidget(self.pushButton_2)
+        self.toolButton_2.setAutoRaise(False)
-        spacerItem = QtWidgets.QSpacerItem(40, 20, QtWidgets.QSizePolicy.Expanding, QtWidgets.QSizePolicy.Minimum)
+        self.toolButton_2.setArrowType(QtCore.Qt.RightArrow)
-        self.horizontalLayout_2.addItem(spacerItem)
+        self.toolButton_2.setObjectName("toolButton_2")
-        self.gridLayout.addLayout(self.horizontalLayout_2, 2, 1, 1, 1)
+        self.verticalLayout_2.addWidget(self.toolButton_2)
+        self.gridLayout.addLayout(self.verticalLayout_2, 0, 2, 1, 1)
         self.tabWidget = QtWidgets.QTabWidget(Dialog)
         self.tabWidget.setTabPosition(QtWidgets.QTabWidget.East)
         self.tabWidget.setObjectName("tabWidget")
@@ -89,37 +92,57 @@ class Ui_Dialog(object):
         self.tabWidgetPage1.setObjectName("tabWidgetPage1")
         self.gridLayout_3 = QtWidgets.QGridLayout(self.tabWidgetPage1)
         self.gridLayout_3.setObjectName("gridLayout_3")
-        self.tg_export_check = QtWidgets.QCheckBox(self.tabWidgetPage1)
-        self.tg_export_check.setChecked(True)
-        self.tg_export_check.setObjectName("tg_export_check")
-        self.gridLayout_3.addWidget(self.tg_export_check, 2, 1, 1, 1)
         self.tglines_export_check = QtWidgets.QCheckBox(self.tabWidgetPage1)
         self.tglines_export_check.setChecked(True)
         self.tglines_export_check.setObjectName("tglines_export_check")
-        self.gridLayout_3.addWidget(self.tglines_export_check, 2, 2, 1, 1)
+        self.gridLayout_3.addWidget(self.tglines_export_check, 2, 3, 1, 1)
-        self.label_6 = QtWidgets.QLabel(self.tabWidgetPage1)
+        self.checkBox_6 = QtWidgets.QCheckBox(self.tabWidgetPage1)
-        self.label_6.setObjectName("label_6")
+        self.checkBox_6.setChecked(True)
-        self.gridLayout_3.addWidget(self.label_6, 4, 1, 1, 1)
+        self.checkBox_6.setObjectName("checkBox_6")
+        self.gridLayout_3.addWidget(self.checkBox_6, 6, 3, 1, 1)
         self.new_graph_tau_combo = QtWidgets.QComboBox(self.tabWidgetPage1)
         self.new_graph_tau_combo.setObjectName("new_graph_tau_combo")
-        self.gridLayout_3.addWidget(self.new_graph_tau_combo, 5, 2, 1, 1)
+        self.gridLayout_3.addWidget(self.new_graph_tau_combo, 8, 3, 1, 1)
-        self.new_graph_tau_check = QtWidgets.QCheckBox(self.tabWidgetPage1)
-        self.new_graph_tau_check.setChecked(True)
-        self.new_graph_tau_check.setObjectName("new_graph_tau_check")
-        self.gridLayout_3.addWidget(self.new_graph_tau_check, 5, 1, 1, 1)
         self.line = QtWidgets.QFrame(self.tabWidgetPage1)
         self.line.setFrameShape(QtWidgets.QFrame.HLine)
         self.line.setFrameShadow(QtWidgets.QFrame.Sunken)
         self.line.setObjectName("line")
-        self.gridLayout_3.addWidget(self.line, 3, 1, 1, 2)
+        self.gridLayout_3.addWidget(self.line, 3, 2, 1, 2)
-        self.hodge_selection = CheckCombobox(self.tabWidgetPage1)
+        self.checkBox = QtWidgets.QCheckBox(self.tabWidgetPage1)
-        self.hodge_selection.setObjectName("hodge_selection")
+        self.checkBox.setChecked(True)
-        self.hodge_selection.addItem("")
+        self.checkBox.setObjectName("checkBox")
-        self.hodge_selection.addItem("")
+        self.gridLayout_3.addWidget(self.checkBox, 5, 2, 1, 1)
-        self.hodge_selection.addItem("")
+        self.tg_export_check = QtWidgets.QCheckBox(self.tabWidgetPage1)
-        self.hodge_selection.addItem("")
+        self.tg_export_check.setChecked(True)
-        self.hodge_selection.addItem("")
+        self.tg_export_check.setObjectName("tg_export_check")
-        self.gridLayout_3.addWidget(self.hodge_selection, 4, 2, 1, 1)
+        self.gridLayout_3.addWidget(self.tg_export_check, 2, 2, 1, 1)
+        self.new_graph_tau_check = QtWidgets.QCheckBox(self.tabWidgetPage1)
+        self.new_graph_tau_check.setChecked(True)
+        self.new_graph_tau_check.setObjectName("new_graph_tau_check")
+        self.gridLayout_3.addWidget(self.new_graph_tau_check, 8, 2, 1, 1)
+        self.checkBox_5 = QtWidgets.QCheckBox(self.tabWidgetPage1)
+        self.checkBox_5.setChecked(True)
+        self.checkBox_5.setObjectName("checkBox_5")
+        self.gridLayout_3.addWidget(self.checkBox_5, 6, 2, 1, 1)
+        spacerItem = QtWidgets.QSpacerItem(20, 40, QtWidgets.QSizePolicy.Minimum, QtWidgets.QSizePolicy.Expanding)
+        self.gridLayout_3.addItem(spacerItem, 10, 3, 1, 1)
+        self.label_6 = QtWidgets.QLabel(self.tabWidgetPage1)
+        self.label_6.setObjectName("label_6")
+        self.gridLayout_3.addWidget(self.label_6, 4, 2, 1, 2)
+        self.checkBox_4 = QtWidgets.QCheckBox(self.tabWidgetPage1)
+        self.checkBox_4.setChecked(True)
+        self.checkBox_4.setObjectName("checkBox_4")
+        self.gridLayout_3.addWidget(self.checkBox_4, 5, 3, 1, 1)
+        self.checkBox_7 = QtWidgets.QCheckBox(self.tabWidgetPage1)
+        self.checkBox_7.setChecked(True)
+        self.checkBox_7.setObjectName("checkBox_7")
+        self.gridLayout_3.addWidget(self.checkBox_7, 7, 2, 1, 1)
+        self.pushButton_4 = QtWidgets.QPushButton(self.tabWidgetPage1)
+        self.pushButton_4.setObjectName("pushButton_4")
+        self.gridLayout_3.addWidget(self.pushButton_4, 9, 2, 1, 2)
+        self.tghodge_graph = PlotWidget(self.tabWidgetPage1)
+        self.tghodge_graph.setObjectName("tghodge_graph")
+        self.gridLayout_3.addWidget(self.tghodge_graph, 2, 1, 9, 1)
         self.tau_plot = PlotWidget(self.tabWidgetPage1)
         sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Expanding, QtWidgets.QSizePolicy.MinimumExpanding)
         sizePolicy.setHorizontalStretch(0)
@@ -127,44 +150,39 @@ class Ui_Dialog(object):
         sizePolicy.setHeightForWidth(self.tau_plot.sizePolicy().hasHeightForWidth())
         self.tau_plot.setSizePolicy(sizePolicy)
         self.tau_plot.setObjectName("tau_plot")
-        self.gridLayout_3.addWidget(self.tau_plot, 0, 0, 8, 1)
+        self.gridLayout_3.addWidget(self.tau_plot, 2, 0, 9, 1)
-        spacerItem1 = QtWidgets.QSpacerItem(20, 40, QtWidgets.QSizePolicy.Minimum, QtWidgets.QSizePolicy.Expanding)
-        self.gridLayout_3.addItem(spacerItem1, 7, 2, 1, 1)
-        self.pushButton_4 = QtWidgets.QPushButton(self.tabWidgetPage1)
-        self.pushButton_4.setObjectName("pushButton_4")
-        self.gridLayout_3.addWidget(self.pushButton_4, 6, 1, 1, 2)
         self.tabWidget.addTab(self.tabWidgetPage1, "")
         self.tabWidgetPage2 = QtWidgets.QWidget()
         self.tabWidgetPage2.setObjectName("tabWidgetPage2")
         self.gridLayout_2 = QtWidgets.QGridLayout(self.tabWidgetPage2)
         self.gridLayout_2.setObjectName("gridLayout_2")
-        self.pushButton_3 = QtWidgets.QPushButton(self.tabWidgetPage2)
+        self.fit_tnhm_fitbutton = QtWidgets.QPushButton(self.tabWidgetPage2)
-        self.pushButton_3.setObjectName("pushButton_3")
+        self.fit_tnhm_fitbutton.setObjectName("fit_tnhm_fitbutton")
-        self.gridLayout_2.addWidget(self.pushButton_3, 1, 1, 1, 2)
+        self.gridLayout_2.addWidget(self.fit_tnhm_fitbutton, 1, 1, 1, 2)
         self.graphicsView_2 = PlotWidget(self.tabWidgetPage2)
         self.graphicsView_2.setObjectName("graphicsView_2")
         self.gridLayout_2.addWidget(self.graphicsView_2, 0, 0, 9, 1)
-        self.checkBox = QtWidgets.QCheckBox(self.tabWidgetPage2)
+        self.new_graph_tnmh_check = QtWidgets.QCheckBox(self.tabWidgetPage2)
-        self.checkBox.setChecked(True)
+        self.new_graph_tnmh_check.setChecked(True)
-        self.checkBox.setObjectName("checkBox")
+        self.new_graph_tnmh_check.setObjectName("new_graph_tnmh_check")
-        self.gridLayout_2.addWidget(self.checkBox, 5, 1, 1, 1)
+        self.gridLayout_2.addWidget(self.new_graph_tnmh_check, 5, 1, 1, 1)
         self.horizontalLayout = QtWidgets.QHBoxLayout()
         self.horizontalLayout.setObjectName("horizontalLayout")
         self.label_2 = QtWidgets.QLabel(self.tabWidgetPage2)
         self.label_2.setObjectName("label_2")
         self.horizontalLayout.addWidget(self.label_2)
-        self.comboBox = QtWidgets.QComboBox(self.tabWidgetPage2)
+        self.tnmh_tg_combo = QtWidgets.QComboBox(self.tabWidgetPage2)
-        self.comboBox.setObjectName("comboBox")
+        self.tnmh_tg_combo.setObjectName("tnmh_tg_combo")
-        self.comboBox.addItem("")
+        self.tnmh_tg_combo.addItem("")
-        self.comboBox.addItem("")
+        self.tnmh_tg_combo.addItem("")
-        self.comboBox.addItem("")
+        self.tnmh_tg_combo.addItem("")
-        self.comboBox.addItem("")
+        self.tnmh_tg_combo.addItem("")
-        self.comboBox.addItem("")
+        self.tnmh_tg_combo.addItem("")
-        self.horizontalLayout.addWidget(self.comboBox)
+        self.horizontalLayout.addWidget(self.tnmh_tg_combo)
         self.gridLayout_2.addLayout(self.horizontalLayout, 0, 1, 1, 2)
-        self.comboBox_2 = QtWidgets.QComboBox(self.tabWidgetPage2)
+        self.new_graph_tnmh_combo = QtWidgets.QComboBox(self.tabWidgetPage2)
-        self.comboBox_2.setObjectName("comboBox_2")
+        self.new_graph_tnmh_combo.setObjectName("new_graph_tnmh_combo")
-        self.gridLayout_2.addWidget(self.comboBox_2, 5, 2, 1, 1)
+        self.gridLayout_2.addWidget(self.new_graph_tnmh_combo, 5, 2, 1, 1)
         self.line_2 = QtWidgets.QFrame(self.tabWidgetPage2)
         self.line_2.setMinimumSize(QtCore.QSize(0, 0))
         self.line_2.setFrameShape(QtWidgets.QFrame.HLine)
@@ -177,13 +195,13 @@ class Ui_Dialog(object):
         self.checkBox_3 = QtWidgets.QCheckBox(self.tabWidgetPage2)
         self.checkBox_3.setObjectName("checkBox_3")
         self.gridLayout_2.addWidget(self.checkBox_3, 4, 1, 1, 2)
-        spacerItem2 = QtWidgets.QSpacerItem(20, 40, QtWidgets.QSizePolicy.Minimum, QtWidgets.QSizePolicy.Expanding)
+        spacerItem1 = QtWidgets.QSpacerItem(20, 40, QtWidgets.QSizePolicy.Minimum, QtWidgets.QSizePolicy.Expanding)
-        self.gridLayout_2.addItem(spacerItem2, 8, 1, 1, 1)
+        self.gridLayout_2.addItem(spacerItem1, 8, 1, 1, 1)
         self.pushButton = QtWidgets.QPushButton(self.tabWidgetPage2)
         self.pushButton.setObjectName("pushButton")
         self.gridLayout_2.addWidget(self.pushButton, 7, 1, 1, 2)
         self.tabWidget.addTab(self.tabWidgetPage2, "")
-        self.gridLayout.addWidget(self.tabWidget, 4, 1, 1, 1)
+        self.gridLayout.addWidget(self.tabWidget, 4, 1, 1, 2)
 
         self.retranslateUi(Dialog)
         self.tabWidget.setCurrentIndex(0)
@@ -197,29 +215,28 @@ class Ui_Dialog(object):
         self.label.setText(_translate("Dialog", "<html><head/><body><p><span style=\" font-weight:600;\">Tg values:</span></p></body></html>"))
         self.label_4.setText(_translate("Dialog", "<html><head/><body><p><span style=\" font-weight:600;\">TNMH parameter:</span></p></body></html>"))
         self.calctg_button.setText(_translate("Dialog", "Calculate Tg"))
-        self.pushButton_2.setText(_translate("Dialog", "Calculate fictive Cp"))
+        self.toolButton_2.setText(_translate("Dialog", "Calculate fictive Cp"))
-        self.tg_export_check.setText(_translate("Dialog", "Export Tg"))
         self.tglines_export_check.setText(_translate("Dialog", "Export lines"))
-        self.label_6.setText(_translate("Dialog", "Export Hodge:"))
+        self.checkBox_6.setText(_translate("Dialog", "End"))
+        self.checkBox.setText(_translate("Dialog", "Onset"))
+        self.tg_export_check.setText(_translate("Dialog", "Export Tg"))
         self.new_graph_tau_check.setText(_translate("Dialog", "New graph"))
-        self.hodge_selection.setItemText(0, _translate("Dialog", "Onset"))
+        self.checkBox_5.setText(_translate("Dialog", "Inflection"))
-        self.hodge_selection.setItemText(1, _translate("Dialog", "Midpoint"))
+        self.label_6.setText(_translate("Dialog", "Export Hodge:"))
-        self.hodge_selection.setItemText(2, _translate("Dialog", "End"))
+        self.checkBox_4.setText(_translate("Dialog", "Midpoint"))
-        self.hodge_selection.setItemText(3, _translate("Dialog", "Inflection"))
+        self.checkBox_7.setText(_translate("Dialog", "Fictive"))
-        self.hodge_selection.setItemText(4, _translate("Dialog", "Fictive"))
+        self.pushButton_4.setText(_translate("Dialog", "Export"))
-        self.pushButton_4.setText(_translate("Dialog", "Save"))
         self.tabWidget.setTabText(self.tabWidget.indexOf(self.tabWidgetPage1), _translate("Dialog", "Tg / Hodge"))
-        self.pushButton_3.setText(_translate("Dialog", "Fit TNMH model"))
+        self.fit_tnhm_fitbutton.setText(_translate("Dialog", "Fit TNMH model"))
-        self.checkBox.setText(_translate("Dialog", "New graph"))
+        self.new_graph_tnmh_check.setText(_translate("Dialog", "New graph"))
         self.label_2.setText(_translate("Dialog", "Tg for TNMH"))
-        self.comboBox.setItemText(0, _translate("Dialog", "Fictive"))
+        self.tnmh_tg_combo.setItemText(0, _translate("Dialog", "Fictive"))
-        self.comboBox.setItemText(1, _translate("Dialog", "Onset"))
+        self.tnmh_tg_combo.setItemText(1, _translate("Dialog", "Onset"))
-        self.comboBox.setItemText(2, _translate("Dialog", "Midpoint"))
+        self.tnmh_tg_combo.setItemText(2, _translate("Dialog", "Midpoint"))
-        self.comboBox.setItemText(3, _translate("Dialog", "End"))
+        self.tnmh_tg_combo.setItemText(3, _translate("Dialog", "End"))
-        self.comboBox.setItemText(4, _translate("Dialog", "Inflection"))
+        self.tnmh_tg_combo.setItemText(4, _translate("Dialog", "Inflection"))
         self.checkBox_2.setText(_translate("Dialog", "Export dTf / dT"))
         self.checkBox_3.setText(_translate("Dialog", "Export fit"))
-        self.pushButton.setText(_translate("Dialog", "Save"))
+        self.pushButton.setText(_translate("Dialog", "Export"))
         self.tabWidget.setTabText(self.tabWidget.indexOf(self.tabWidgetPage2), _translate("Dialog", "TNMH"))
-from ..lib.forms import CheckCombobox
 from pyqtgraph import PlotWidget

src/gui_qt/dsc/glass_dialog.py

@@ -27,19 +27,46 @@ class TgCalculator(QtWidgets.QDialog, Ui_Dialog):
         self._plots = {}
         self._tg_value = {}
         self._fit = {}
-        self._lines = {}
         self._hodge = {
-            'onset': (PlotItem(x=[], y=[], pen=None, symbol='o', symbolBrush=Tab10.TabBlue.rgb(), name='Onset'), None),
+            'onset': (
-            'midpoint': (PlotItem(x=[], y=[], pen=None, symbol='s', symbolBrush=Tab10.TabOrange.rgb(), name='Midpoint'), None),
+                PlotItem(x=[], y=[], pen=None, symbol='o', symbolBrush=Tab10.TabBlue.rgb(), name='Onset'),
-            'end': (PlotItem(x=[], y=[], pen=None, symbol='t', symbolBrush=Tab10.TabGreen.rgb(), name='End'), None),
+                None,
-            'inflection': (PlotItem(x=[], y=[], pen=None, symbol='d', symbolBrush=Tab10.TabRed.rgb(), name='Inflection'), None),
+                (PlotItem(x=[], y=[], pen=mkPen({'color': Tab10.TabBlue.rgb()})),
+                 PlotItem(x=[], y=[], pen=None, symbol='o', symbolBrush=Tab10.TabBlue.rgb())),
+                None,
+            ),
+            'midpoint': (
+                PlotItem(x=[], y=[], pen=None, symbol='s', symbolBrush=Tab10.TabOrange.rgb(), name='Midpoint'),
+                None,
+                (PlotItem(x=[], y=[], pen=mkPen({'color': Tab10.TabOrange.rgb()})),
+                 PlotItem(x=[], y=[], pen=None, symbol='s', symbolBrush=Tab10.TabOrange.rgb())),
+                None,
+            ),
+            'end': (
+                PlotItem(x=[], y=[], pen=None, symbol='t', symbolBrush=Tab10.TabGreen.rgb(), name='End'),
+                None,
+                (PlotItem(x=[], y=[], pen=mkPen({'color': Tab10.TabGreen.rgb()})),
+                 PlotItem(x=[], y=[], pen=None, symbol='t', symbolBrush=Tab10.TabGreen.rgb())),
+                None,
+            ),
+            'inflection': (
+                PlotItem(x=[], y=[], pen=None, symbol='d', symbolBrush=Tab10.TabRed.rgb(), name='Inflection'),
+                None,
+                (PlotItem(x=[], y=[], pen=mkPen({'color': Tab10.TabRed.rgb()})),
+                 PlotItem(x=[], y=[], pen=None, symbol='d', symbolBrush=Tab10.TabRed.rgb())),
+                None,
+            ),
             # 'fictive': PlotItem(x=[], y=[], pen=None, symbol='t1', symbolBrush=Tab10.TabPurple.rgb(), name='Fictive'),
             # 'TNMH': PlotItem(x=[], y=[], pen=None, symbol='star', symbolBrush=Tab10.TabPurple.rgb(), name='TNMH'),
         }
+        self._lines = {}
         self.tau_plot.getPlotItem().addLegend()
-        for plt, _ in self._hodge.values():
+        for plt, _, fitplt, _ in self._hodge.values():
             self.tau_plot.addItem(plt)
+            self.tghodge_graph.addItem(fitplt[0])
+            self.tghodge_graph.addItem(fitplt[1])
         self.tau_plot.setLogMode(y=True)
+        self.tghodge_graph.setLogMode(y=True)
 
         self.limits = RegionItem(), RegionItem()
         for lim in self.limits:
@@ -69,7 +96,9 @@ class TgCalculator(QtWidgets.QDialog, Ui_Dialog):
 
         for key, plt in self._hodge.items():
             plt[0].setData(x=[], y=[])
-            self._hodge[key] = (plt[0], None)
+            plt[2][0].setData(x=[], y=[])
+            plt[2][1].setData(x=[], y=[])
+            self._hodge[key] = (plt[0], None, plt[2], None)
 
         self._dsc = {}
         self._plots = {}
@@ -242,7 +271,7 @@ class TgCalculator(QtWidgets.QDialog, Ui_Dialog):
             plot[-1].setData(res.x, res.y)
 
     def hodge(self):
-        for tg_type, (plot, data) in self._hodge.items():
+        for tg_type, (plot, data, fitplots, fit) in self._hodge.items():
 
             m = []
             for idx in range(self.listWidget.count()):
@@ -260,11 +289,13 @@ class TgCalculator(QtWidgets.QDialog, Ui_Dialog):
                 m.append([tg_value, data.value])
 
             if len(m) > 1:
-                data = tau_hodge(*array(m).T)
+                data, fit = tau_hodge(*array(m).T)
                 data.name = f'{data.name} ({tg_type.capitalize()})'
                 plot.setData(data.x, data.y)
+                fitplots[0].setData(1000/fit.x, fit.y)
+                fitplots[1].setData(1000/fit.x_data, fit.y_data)
 
-                self._hodge[tg_type] = (plot, data)
+                self._hodge[tg_type] = (plot, data, fitplots, fit)
 
     def close(self) -> bool:
         self.clear()

src/nmreval/dsc/hodge.py

@@ -3,12 +3,13 @@ from scipy.stats import linregress
 
 from nmreval.data import Points
 from nmreval.fit.minimizer import FitRoutine
+from nmreval.fit.result import FitResult
 from nmreval.lib.utils import ArrayLike
 from nmreval.models import Arrhenius
 from nmreval.utils import kB
 
 
-def tau_hodge(tg: ArrayLike, rate: ArrayLike) -> Points:
+def tau_hodge(tg: ArrayLike, rate: ArrayLike) -> (Points, FitResult):
     rate = np.asanyarray(rate) / 60
     tg = np.asanyarray(tg)
     fitter = FitRoutine()
@@ -23,4 +24,4 @@ def tau_hodge(tg: ArrayLike, rate: ArrayLike) -> Points:
     de = res.parameter['E_{A}']
     tau = kB*tg**2/np.abs(de.value)/rate
 
-    return Points(x=1000/tg, y=tau, y_err=tau*de.error/np.abs(de.value), name='Hodge')
+    return Points(x=1000/tg, y=tau, y_err=tau*de.error/np.abs(de.value), name='Hodge'), res

src/resources/_ui/tnmh_dialog.ui

@@ -6,8 +6,8 @@
    <rect>
     <x>0</x>
     <y>0</y>
-    <width>1041</width>
+    <width>1094</width>
-    <height>773</height>
+    <height>829</height>
    </rect>
   </property>
   <property name="windowTitle">
@@ -85,12 +85,12 @@
      </property>
     </widget>
    </item>
-   <item row="2" column="1">
+   <item row="0" column="2">
-    <layout class="QHBoxLayout" name="horizontalLayout_2">
+    <layout class="QVBoxLayout" name="verticalLayout_2">
      <item>
-      <widget class="QPushButton" name="calctg_button">
+      <widget class="QToolButton" name="calctg_button">
        <property name="sizePolicy">
-        <sizepolicy hsizetype="Maximum" vsizetype="Fixed">
+        <sizepolicy hsizetype="Preferred" vsizetype="Preferred">
          <horstretch>0</horstretch>
          <verstretch>0</verstretch>
         </sizepolicy>
@@ -98,12 +98,18 @@
        <property name="text">
         <string>Calculate Tg</string>
        </property>
+       <property name="toolButtonStyle">
+        <enum>Qt::ToolButtonTextBesideIcon</enum>
+       </property>
+       <property name="arrowType">
+        <enum>Qt::RightArrow</enum>
+       </property>
       </widget>
      </item>
      <item>
-      <widget class="QPushButton" name="pushButton_2">
+      <widget class="QToolButton" name="toolButton_2">
        <property name="sizePolicy">
-        <sizepolicy hsizetype="Maximum" vsizetype="Fixed">
+        <sizepolicy hsizetype="Maximum" vsizetype="Preferred">
          <horstretch>0</horstretch>
          <verstretch>0</verstretch>
         </sizepolicy>
@@ -111,47 +117,33 @@
        <property name="text">
         <string>Calculate fictive Cp</string>
        </property>
+       <property name="toolButtonStyle">
+        <enum>Qt::ToolButtonTextBesideIcon</enum>
+       </property>
+       <property name="autoRaise">
+        <bool>false</bool>
+       </property>
+       <property name="arrowType">
+        <enum>Qt::RightArrow</enum>
+       </property>
       </widget>
      </item>
-     <item>
-      <spacer name="horizontalSpacer">
-       <property name="orientation">
-        <enum>Qt::Horizontal</enum>
-       </property>
-       <property name="sizeHint" stdset="0">
-        <size>
-         <width>40</width>
-         <height>20</height>
-        </size>
-       </property>
-      </spacer>
-     </item>
     </layout>
    </item>
-   <item row="4" column="1">
+   <item row="4" column="1" colspan="2">
     <widget class="QTabWidget" name="tabWidget">
      <property name="tabPosition">
       <enum>QTabWidget::East</enum>
      </property>
      <property name="currentIndex">
-      <number>1</number>
+      <number>0</number>
      </property>
      <widget class="QWidget" name="tabWidgetPage1">
       <attribute name="title">
        <string>Tg / Hodge</string>
       </attribute>
       <layout class="QGridLayout" name="gridLayout_3">
-       <item row="2" column="1">
+       <item row="2" column="3">
-        <widget class="QCheckBox" name="tg_export_check">
-         <property name="text">
-          <string>Export Tg</string>
-         </property>
-         <property name="checked">
-          <bool>true</bool>
-         </property>
-        </widget>
-       </item>
-       <item row="2" column="2">
         <widget class="QCheckBox" name="tglines_export_check">
          <property name="text">
           <string>Export lines</string>
@@ -161,17 +153,47 @@
          </property>
         </widget>
        </item>
-       <item row="4" column="1">
+       <item row="6" column="3">
-        <widget class="QLabel" name="label_6">
+        <widget class="QCheckBox" name="checkBox_6">
          <property name="text">
-          <string>Export Hodge:</string>
+          <string>End</string>
+         </property>
+         <property name="checked">
+          <bool>true</bool>
+         </property>
+        </widget>
+       </item>
+       <item row="8" column="3">
+        <widget class="QComboBox" name="new_graph_tau_combo"/>
+       </item>
+       <item row="3" column="2" colspan="2">
+        <widget class="Line" name="line">
+         <property name="orientation">
+          <enum>Qt::Horizontal</enum>
          </property>
         </widget>
        </item>
        <item row="5" column="2">
-        <widget class="QComboBox" name="new_graph_tau_combo"/>
+        <widget class="QCheckBox" name="checkBox">
+         <property name="text">
+          <string>Onset</string>
+         </property>
+         <property name="checked">
+          <bool>true</bool>
+         </property>
+        </widget>
        </item>
-       <item row="5" column="1">
+       <item row="2" column="2">
+        <widget class="QCheckBox" name="tg_export_check">
+         <property name="text">
+          <string>Export Tg</string>
+         </property>
+         <property name="checked">
+          <bool>true</bool>
+         </property>
+        </widget>
+       </item>
+       <item row="8" column="2">
         <widget class="QCheckBox" name="new_graph_tau_check">
          <property name="text">
           <string>New graph</string>
@@ -181,53 +203,17 @@
          </property>
         </widget>
        </item>
-       <item row="3" column="1" colspan="2">
+       <item row="6" column="2">
-        <widget class="Line" name="line">
+        <widget class="QCheckBox" name="checkBox_5">
-         <property name="orientation">
+         <property name="text">
-          <enum>Qt::Horizontal</enum>
+          <string>Inflection</string>
+         </property>
+         <property name="checked">
+          <bool>true</bool>
          </property>
         </widget>
        </item>
-       <item row="4" column="2">
+       <item row="10" column="3">
-        <widget class="CheckCombobox" name="hodge_selection">
-         <item>
-          <property name="text">
-           <string>Onset</string>
-          </property>
-         </item>
-         <item>
-          <property name="text">
-           <string>Midpoint</string>
-          </property>
-         </item>
-         <item>
-          <property name="text">
-           <string>End</string>
-          </property>
-         </item>
-         <item>
-          <property name="text">
-           <string>Inflection</string>
-          </property>
-         </item>
-         <item>
-          <property name="text">
-           <string>Fictive</string>
-          </property>
-         </item>
-        </widget>
-       </item>
-       <item row="0" column="0" rowspan="8">
-        <widget class="PlotWidget" name="tau_plot">
-         <property name="sizePolicy">
-          <sizepolicy hsizetype="Expanding" vsizetype="MinimumExpanding">
-           <horstretch>0</horstretch>
-           <verstretch>0</verstretch>
-          </sizepolicy>
-         </property>
-        </widget>
-       </item>
-       <item row="7" column="2">
         <spacer name="verticalSpacer">
          <property name="orientation">
           <enum>Qt::Vertical</enum>
@@ -240,10 +226,50 @@
          </property>
         </spacer>
        </item>
-       <item row="6" column="1" colspan="2">
+       <item row="4" column="2" colspan="2">
+        <widget class="QLabel" name="label_6">
+         <property name="text">
+          <string>Export Hodge:</string>
+         </property>
+        </widget>
+       </item>
+       <item row="5" column="3">
+        <widget class="QCheckBox" name="checkBox_4">
+         <property name="text">
+          <string>Midpoint</string>
+         </property>
+         <property name="checked">
+          <bool>true</bool>
+         </property>
+        </widget>
+       </item>
+       <item row="7" column="2">
+        <widget class="QCheckBox" name="checkBox_7">
+         <property name="text">
+          <string>Fictive</string>
+         </property>
+         <property name="checked">
+          <bool>true</bool>
+         </property>
+        </widget>
+       </item>
+       <item row="9" column="2" colspan="2">
         <widget class="QPushButton" name="pushButton_4">
          <property name="text">
-          <string>Save</string>
+          <string>Export</string>
+         </property>
+        </widget>
+       </item>
+       <item row="2" column="1" rowspan="9">
+        <widget class="PlotWidget" name="tghodge_graph"/>
+       </item>
+       <item row="2" column="0" rowspan="9">
+        <widget class="PlotWidget" name="tau_plot">
+         <property name="sizePolicy">
+          <sizepolicy hsizetype="Expanding" vsizetype="MinimumExpanding">
+           <horstretch>0</horstretch>
+           <verstretch>0</verstretch>
+          </sizepolicy>
          </property>
         </widget>
        </item>
@@ -360,7 +386,7 @@
        <item row="7" column="1" colspan="2">
         <widget class="QPushButton" name="pushButton">
          <property name="text">
-          <string>Save</string>
+          <string>Export</string>
          </property>
         </widget>
        </item>
@@ -376,11 +402,6 @@
    <extends>QGraphicsView</extends>
    <header>pyqtgraph</header>
   </customwidget>
-  <customwidget>
-   <class>CheckCombobox</class>
-   <extends>QComboBox</extends>
-   <header>..lib.forms</header>
-  </customwidget>
  </customwidgets>
  <resources/>
  <connections>