bugfix: update sets after graph selection;

check for config on start
color cycles added;

bin/evaluate.py

@@ -4,6 +4,11 @@ import sys
 import pathlib
 sys.path.append(str(pathlib.Path().cwd().parent))
 
+from nmreval.configs import check_for_config
+
+# does a directory for config stuff exist? create it if not
+check_for_config()
+
 # pyqtgraph warns on Mac if QApplication is created when it is imported
 # import pyqtgraph
 

nmreval/configs.py

@@ -1,25 +1,44 @@
 import configparser
 import pathlib
 import pickle
-import logging.handlers
+from shutil import copyfile
+from importlib.resources import path as resource_path
 
 
-__all__ = ['config_paths', 'read_configuration', 'write_configuration', 'allowed_values', 'write_state', 'read_state']
+__all__ = ['config_paths', 'check_for_config', 'read_configuration', 'write_configuration', 'allowed_values', 'write_state', 'read_state']
+
+
+def check_for_config(make=True):
+    try:
+        config_paths()
+    except FileNotFoundError as e:
+        if make:
+            conf_path = pathlib.Path('~/.auswerten').expanduser()
+            conf_path.mkdir(parents=True)
+            cwd = pathlib.Path(__file__).parent
+            copyfile(cwd / 'models' / 'usermodels.py', conf_path / 'usermodels.py')
+            with resource_path('resources', 'Default.agr') as fp:
+               copyfile(fp, conf_path / 'Default.agr')
+
+        else:
+            raise e
 
 
 def config_paths() -> pathlib.Path:
     # TODO adjust for different OS
-    searchpaths = ['~/.local/share/auswerten', '~/.auswerten', '/usr/share/nmreval']
+    searchpaths = ['~/.config/nmreval', '~/.auswerten', '/usr/share/nmreval']
-    path = None
+    conf_path = None
+
     for p in searchpaths:
         path = pathlib.Path(p).expanduser()
         if path.exists():
+            conf_path = path
             break
 
-    if path is None:
+    if conf_path is None:
         raise FileNotFoundError('No valid configuration path found')
 
-    return path
+    return conf_path
 
 
 def read_configuration() -> configparser.ConfigParser:

nmreval/gui_qt/_py/basewindow.py

@@ -233,8 +233,8 @@ class Ui_BaseWindow(object):
         self.actionShow_log.setObjectName("actionShow_log")
         self.action_create_fit_function = QtWidgets.QAction(BaseWindow)
         self.action_create_fit_function.setObjectName("action_create_fit_function")
-        self.actionGrace_preferences = QtWidgets.QAction(BaseWindow)
+        self.action_colorcycle = QtWidgets.QAction(BaseWindow)
-        self.actionGrace_preferences.setObjectName("actionGrace_preferences")
+        self.action_colorcycle.setObjectName("action_colorcycle")
         self.actionSave_session = QtWidgets.QAction(BaseWindow)
         self.actionSave_session.setObjectName("actionSave_session")
         self.actionMouse_behaviour = QtWidgets.QAction(BaseWindow)
@@ -420,7 +420,7 @@ class Ui_BaseWindow(object):
         self.menuFit.addAction(self.menuLimits.menuAction())
         self.menuOptions.addAction(self.actionMouse_behaviour)
         self.menuOptions.addSeparator()
-        self.menuOptions.addAction(self.actionGrace_preferences)
+        self.menuOptions.addAction(self.action_colorcycle)
         self.menuOptions.addAction(self.actionConfiguration)
         self.menuView.addAction(self.actionTile)
         self.menuView.addAction(self.actionCascade_windows)
@@ -547,7 +547,7 @@ class Ui_BaseWindow(object):
         self.actionShift.setText(_translate("BaseWindow", "&Shift/scale..."))
         self.actionShow_log.setText(_translate("BaseWindow", "&Show log..."))
         self.action_create_fit_function.setText(_translate("BaseWindow", "&Create fit function..."))
-        self.actionGrace_preferences.setText(_translate("BaseWindow", "&Grace preferences..."))
+        self.action_colorcycle.setText(_translate("BaseWindow", "Color cycles..."))
         self.actionSave_session.setText(_translate("BaseWindow", "Update session"))
         self.actionMouse_behaviour.setText(_translate("BaseWindow", "Mouse behaviour"))
         self.actionMouse_behaviour.setToolTip(_translate("BaseWindow", "Switch between zoom and pan in graph."))

nmreval/gui_qt/_py/color_palette.py

@@ -15,12 +15,9 @@ class Ui_Dialog(object):
         Dialog.setObjectName("Dialog")
         Dialog.resize(390, 409)
         self.gridLayout = QtWidgets.QGridLayout(Dialog)
+        self.gridLayout.setContentsMargins(3, 3, 3, 3)
+        self.gridLayout.setSpacing(3)
         self.gridLayout.setObjectName("gridLayout")
-        self.append_palette_button = QtWidgets.QPushButton(Dialog)
-        self.append_palette_button.setObjectName("append_palette_button")
-        self.gridLayout.addWidget(self.append_palette_button, 2, 0, 1, 1)
-        spacerItem = QtWidgets.QSpacerItem(20, 40, QtWidgets.QSizePolicy.Minimum, QtWidgets.QSizePolicy.Expanding)
-        self.gridLayout.addItem(spacerItem, 4, 0, 1, 1)
         self.palette_combobox = QtWidgets.QComboBox(Dialog)
         sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.MinimumExpanding, QtWidgets.QSizePolicy.Fixed)
         sizePolicy.setHorizontalStretch(0)
@@ -28,7 +25,7 @@ class Ui_Dialog(object):
         sizePolicy.setHeightForWidth(self.palette_combobox.sizePolicy().hasHeightForWidth())
         self.palette_combobox.setSizePolicy(sizePolicy)
         self.palette_combobox.setObjectName("palette_combobox")
-        self.gridLayout.addWidget(self.palette_combobox, 0, 0, 1, 1)
+        self.gridLayout.addWidget(self.palette_combobox, 0, 1, 1, 2)
         self.add_color_button = QtWidgets.QPushButton(Dialog)
         sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.MinimumExpanding, QtWidgets.QSizePolicy.Fixed)
         sizePolicy.setHorizontalStretch(0)
@@ -36,24 +33,7 @@ class Ui_Dialog(object):
         sizePolicy.setHeightForWidth(self.add_color_button.sizePolicy().hasHeightForWidth())
         self.add_color_button.setSizePolicy(sizePolicy)
         self.add_color_button.setObjectName("add_color_button")
-        self.gridLayout.addWidget(self.add_color_button, 6, 0, 1, 1)
+        self.gridLayout.addWidget(self.add_color_button, 3, 2, 1, 1)
-        self.color_combobox = ColorListEditor(Dialog)
-        sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.MinimumExpanding, QtWidgets.QSizePolicy.Fixed)
-        sizePolicy.setHorizontalStretch(0)
-        sizePolicy.setVerticalStretch(0)
-        sizePolicy.setHeightForWidth(self.color_combobox.sizePolicy().hasHeightForWidth())
-        self.color_combobox.setSizePolicy(sizePolicy)
-        self.color_combobox.setObjectName("color_combobox")
-        self.gridLayout.addWidget(self.color_combobox, 5, 0, 1, 1)
-        self.save_button = QtWidgets.QPushButton(Dialog)
-        self.save_button.setObjectName("save_button")
-        self.gridLayout.addWidget(self.save_button, 9, 1, 1, 1)
-        self.add_palette_button = QtWidgets.QPushButton(Dialog)
-        self.add_palette_button.setObjectName("add_palette_button")
-        self.gridLayout.addWidget(self.add_palette_button, 1, 0, 1, 1)
-        self.new_name_edit = QtWidgets.QLineEdit(Dialog)
-        self.new_name_edit.setObjectName("new_name_edit")
-        self.gridLayout.addWidget(self.new_name_edit, 9, 2, 1, 1)
         self.colorlist = QtWidgets.QListWidget(Dialog)
         sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.Expanding, QtWidgets.QSizePolicy.Expanding)
         sizePolicy.setHorizontalStretch(0)
@@ -62,12 +42,50 @@ class Ui_Dialog(object):
         self.colorlist.setSizePolicy(sizePolicy)
         self.colorlist.setDragDropMode(QtWidgets.QAbstractItemView.InternalMove)
         self.colorlist.setObjectName("colorlist")
-        self.gridLayout.addWidget(self.colorlist, 0, 1, 9, 2)
+        self.gridLayout.addWidget(self.colorlist, 4, 1, 1, 2)
+        self.add_palette_button = QtWidgets.QPushButton(Dialog)
+        self.add_palette_button.setObjectName("add_palette_button")
+        self.gridLayout.addWidget(self.add_palette_button, 1, 1, 1, 1)
+        self.new_name_edit = QtWidgets.QLineEdit(Dialog)
+        self.new_name_edit.setObjectName("new_name_edit")
+        self.gridLayout.addWidget(self.new_name_edit, 6, 1, 1, 2)
         self.buttonBox = QtWidgets.QDialogButtonBox(Dialog)
         self.buttonBox.setOrientation(QtCore.Qt.Horizontal)
         self.buttonBox.setStandardButtons(QtWidgets.QDialogButtonBox.Cancel|QtWidgets.QDialogButtonBox.Ok)
         self.buttonBox.setObjectName("buttonBox")
-        self.gridLayout.addWidget(self.buttonBox, 10, 0, 1, 3)
+        self.gridLayout.addWidget(self.buttonBox, 7, 0, 1, 3)
+        self.color_combobox = ColorListEditor(Dialog)
+        sizePolicy = QtWidgets.QSizePolicy(QtWidgets.QSizePolicy.MinimumExpanding, QtWidgets.QSizePolicy.Fixed)
+        sizePolicy.setHorizontalStretch(0)
+        sizePolicy.setVerticalStretch(0)
+        sizePolicy.setHeightForWidth(self.color_combobox.sizePolicy().hasHeightForWidth())
+        self.color_combobox.setSizePolicy(sizePolicy)
+        self.color_combobox.setObjectName("color_combobox")
+        self.gridLayout.addWidget(self.color_combobox, 3, 1, 1, 1)
+        self.line = QtWidgets.QFrame(Dialog)
+        self.line.setFrameShape(QtWidgets.QFrame.HLine)
+        self.line.setFrameShadow(QtWidgets.QFrame.Sunken)
+        self.line.setObjectName("line")
+        self.gridLayout.addWidget(self.line, 2, 0, 1, 3)
+        self.save_button = QtWidgets.QPushButton(Dialog)
+        self.save_button.setObjectName("save_button")
+        self.gridLayout.addWidget(self.save_button, 6, 0, 1, 1)
+        self.label = QtWidgets.QLabel(Dialog)
+        self.label.setObjectName("label")
+        self.gridLayout.addWidget(self.label, 0, 0, 1, 1)
+        self.append_palette_button = QtWidgets.QPushButton(Dialog)
+        self.append_palette_button.setObjectName("append_palette_button")
+        self.gridLayout.addWidget(self.append_palette_button, 1, 2, 1, 1)
+        self.label_2 = QtWidgets.QLabel(Dialog)
+        self.label_2.setObjectName("label_2")
+        self.gridLayout.addWidget(self.label_2, 3, 0, 1, 1)
+        self.line_2 = QtWidgets.QFrame(Dialog)
+        self.line_2.setFrameShape(QtWidgets.QFrame.HLine)
+        self.line_2.setFrameShadow(QtWidgets.QFrame.Sunken)
+        self.line_2.setObjectName("line_2")
+        self.gridLayout.addWidget(self.line_2, 5, 0, 1, 3)
+        self.label.setBuddy(self.palette_combobox)
+        self.label_2.setBuddy(self.color_combobox)
 
         self.retranslateUi(Dialog)
         self.buttonBox.accepted.connect(Dialog.accept)
@@ -76,9 +94,11 @@ class Ui_Dialog(object):
 
     def retranslateUi(self, Dialog):
         _translate = QtCore.QCoreApplication.translate
-        Dialog.setWindowTitle(_translate("Dialog", "Color Palette"))
+        Dialog.setWindowTitle(_translate("Dialog", "Color cycles"))
-        self.append_palette_button.setText(_translate("Dialog", "Append"))
         self.add_color_button.setText(_translate("Dialog", "Add color"))
-        self.save_button.setText(_translate("Dialog", "Save as new list"))
         self.add_palette_button.setText(_translate("Dialog", "Load"))
+        self.save_button.setText(_translate("Dialog", "Save as new list"))
+        self.label.setText(_translate("Dialog", "Color cycles"))
+        self.append_palette_button.setText(_translate("Dialog", "Append"))
+        self.label_2.setText(_translate("Dialog", "Available color"))
 from ..lib.delegates import ColorListEditor

nmreval/gui_qt/data/container.py

@@ -14,7 +14,7 @@ from ...lib.lines import LineStyle
 from ...lib.symbols import SymbolStyle, symbolcycle
 from ...data.nmr import Spectrum, FID
 
-from ..Qt import QtCore
+from ..Qt import QtCore, QtGui
 from ..io.exporters import GraceExporter
 from ..lib.decorators import plot_update
 from ..lib.pg_objects import ErrorBars, PlotItem
@@ -278,7 +278,9 @@ class ExperimentContainer(QtCore.QObject):
 
     def get_properties(self) -> dict:
         props = OrderedDict()
-        props['General'] = OrderedDict([('Name', self.name), ('Value', str(self.value)), ('Group', str(self.group))])
+        props['General'] = OrderedDict([('Name', self.name),
+                                        ('Value', str(self.value)),
+                                        ('Group', str(self.group))])
         props['Symbol'] = OrderedDict()
         props['Line'] = OrderedDict()
 
@@ -302,15 +304,11 @@ class ExperimentContainer(QtCore.QObject):
         return props
 
     def setColor(self, color, symbol=False, line=False, mode='real'):
-        if mode == 'real':
+        if mode in ['real', 'all']:
             self.plot_real.set_color(color, symbol=symbol, line=line)
-            if self.plot_real.symbol != SymbolStyle.No and symbol:
+            if self.plot_error is not None:
-                err_pen = self.plot_error.pen
+                err_pen = self.plot_error.opts['pen']
-                err_pen.setColor(self.plot_real.symbolcolor.rbg())
+                err_pen.setColor(QtGui.QColor(*self.plot_real.symbolcolor.rgb()))
-                self.plot_error.setData(pen=err_pen)
-            elif line:
-                err_pen = self.plot_error.pen
-                err_pen.setColor(self.plot_real.linecolor.rbg())
                 self.plot_error.setData(pen=err_pen)
 
         elif mode == 'imag' and self.plot_imag is not None:
@@ -319,17 +317,25 @@ class ExperimentContainer(QtCore.QObject):
             print('Updating color failed for ' + str(self.id))
 
     def setSymbol(self, symbol=None, color=None, size=None, mode='real'):
-        if mode == 'real':
+        if mode in ['real', 'all']:
             self.plot_real.set_symbol(symbol=symbol, size=size, color=color)
-        elif mode == 'imag' and self.plot_imag is not None:
+            if color is not None and self.plot_error is not None and self.plot_real.symbol != SymbolStyle.No:
+                err_pen = self.plot_error.opts['pen']
+                err_pen.setColor(QtGui.QColor(*self.plot_real.symbolcolor.rgb()))
+                self.plot_error.setData(pen=err_pen)
+        elif mode in ['imag', 'all'] and self.plot_imag is not None:
             self.plot_imag.set_symbol(symbol=symbol, size=size, color=color)
         else:
             print('Updating symbol failed for ' + str(self.id))
 
     def setLine(self, width=None, style=None, color=None, mode='real'):
-        if mode == 'real':
+        if mode in ['real', 'all']:
             self.plot_real.set_line(width=width, style=style, color=color)
-        elif mode == 'imag' and self.plot_imag is not None:
+            if color is not None and self.plot_error is not None and self.plot_real.symbol == SymbolStyle.No:
+                err_pen = self.plot_error.opts['pen']
+                err_pen.setColor(QtGui.QColor(*self.plot_real.linecolor.rgb()))
+                self.plot_error.setData(pen=err_pen)
+        elif mode in ['imag', 'all'] and self.plot_imag is not None:
             self.plot_imag.set_line(width=width, style=style, color=color)
         else:
             print('Updating line failed for ' + str(self.id))
@@ -532,12 +538,6 @@ class PointContainer(ExperimentContainer):
             self.plot_error = ErrorBars(x=self._data.x, y=self._data.y, top=self._data.y_err, bottom=self._data.y_err,
                                         pen=mkPen({'color': self.plot_real.linecolor.rgb()}))
 
-    def update_property(self, key1: str, key2: str, value: Any):
-        # update default color
-        if key1 == 'Symbol' and key2 == 'Color':
-            self.plot_real.set_color(value, symbol=True, line=False)
-        super().update_property(key1, key2, value)
-
 
 class FitContainer(ExperimentContainer):
     def __init__(self, identifier, data, **kwargs):

nmreval/gui_qt/data/datawidget/datawidget.py

@@ -1,5 +1,6 @@
 from typing import List, Tuple, Union
 
+from nmreval.lib.colors import available_cycles
 from .properties import PropWidget
 from ...Qt import QtWidgets, QtGui, QtCore
 from ..._py.datawidget import Ui_DataWidget
@@ -99,6 +100,7 @@ class DataTree(QtWidgets.QTreeWidget):
                         child = item.child(i)
                         child.setCheckState(0, QtCore.Qt.Checked)
                         to_be_shown.add(child.data(0, QtCore.Qt.UserRole))
+                        self._checked_sets.add(child.data(0, QtCore.Qt.UserRole))
                     self.blockSignals(False)
 
                 # check state change to unchecked
@@ -303,10 +305,10 @@ class DataTree(QtWidgets.QTreeWidget):
 
             iterator += 1
 
-    def contextMenuEvent(self, evt):
+    def contextMenuEvent(self, evt, color_list=None):
         menu = QtWidgets.QMenu()
-        d = menu.addAction('Hello')
+        _ = menu.addAction('Hello')
-        d.setEnabled(False)
+        _.setEnabled(False)
         menu.addSeparator()
 
         idx = self.selectedIndexes()
@@ -326,6 +328,10 @@ class DataTree(QtWidgets.QTreeWidget):
             cat_action = menu.addAction('Join us!')
             plt_action = None
             save_action = None
+            menu.addSeparator()
+            col_menu = menu.addMenu('Color cycle')
+            for c in available_cycles.keys():
+                col_menu.addAction(c)
 
             idx = {}
             has_fits = False
@@ -355,10 +361,11 @@ class DataTree(QtWidgets.QTreeWidget):
 
             action = menu.exec(evt.globalPos())
 
-            if action == del_action:
             s = []
             for gid, sets in idx.items():
                 s.extend(sets)
+
+            if action == del_action:
                 self.management.delete_sets(s)
 
             elif action == cp_action:
@@ -366,23 +373,17 @@ class DataTree(QtWidgets.QTreeWidget):
                     self.management.copy_sets(sets, gid)
 
             elif action == cat_action:
-                s = []
-                for gid, sets in idx.items():
-                    s.extend(sets)
                 self.management.cat(s)
 
             elif action == plt_action:
-                s = []
-                for gid, sets in idx.items():
-                    s.extend(sets)
                 self.management.make_fit_parameter(s)
 
             elif action == save_action:
-                s = []
-                for gid, sets in idx.items():
-                    s.extend(sets)
                 self.saveFits.emit(s)
 
+            elif action.parent() == col_menu:
+                self.management.set_cycle(s, action.text())
+
         evt.accept()
 
     def highlight(self, gid: str):

nmreval/gui_qt/graphs/graphwindow.py

@@ -8,7 +8,7 @@ from typing import List, Union
 from numpy import errstate, floor, log10
 from pyqtgraph import GraphicsObject, getConfigOption, mkColor
 
-from ..lib.pg_objects import RegionItem
+from ..lib.pg_objects import LegendItemBlock, RegionItem
 from ...utils.text import convert
 from ..Qt import QtCore, QtWidgets, QtGui
 from .._py.graph import Ui_GraphWindow
@@ -86,10 +86,10 @@ class QGraphWindow(QtWidgets.QGraphicsView, Ui_GraphWindow):
                 ax.setStyle(showValues=False)
                 ax.setWidth(10)
 
-        self.legend = self.plotItem.addLegend()
+        self.legend = LegendItemBlock(offset=(20, 20))
+        self.legend.setParentItem(self.plotItem.vb)
+        self.plotItem.legend = self.legend
         self.legend.setVisible(True)
-        # self.legend.setBrush(color=self._bgcolor)
-        self.legend.layout.setContentsMargins(1, 1, 1, 1)
 
         self.plotItem.setMenuEnabled(False, True)
         self.plotItem.ctrl.logXCheck.blockSignals(True)

nmreval/gui_qt/lib/color_dialog.py

@@ -1,16 +1,16 @@
 from ...configs import config_paths
 from ..Qt import QtWidgets, QtCore, QtGui
 from .._py.color_palette import Ui_Dialog
-from ...lib.colors import Colors, get_palettes
+from ...lib.colors import Colors, available_cycles
 
 
-class PaletteDialog(QtWidgets.QDialog, Ui_Dialog):
+class ColorDialog(QtWidgets.QDialog, Ui_Dialog):
 
     def __init__(self, parent=None):
         super().__init__(parent=parent)
         self.setupUi(self)
 
-        self._palettes = get_palettes()
+        self._palettes = available_cycles
         self.palette_combobox.addItems(self._palettes.keys())
 
         self.colorlist.installEventFilter(self)
@@ -26,7 +26,7 @@ class PaletteDialog(QtWidgets.QDialog, Ui_Dialog):
 
     @QtCore.pyqtSlot(name='on_add_palette_button_pressed')
     @QtCore.pyqtSlot(name='on_append_palette_button_pressed')
-    def set_palette(self, clear=True):
+    def set_palette(self, clear: bool = False):
         if self.sender() == self.add_palette_button or clear:
             self.colorlist.clear()
 
@@ -49,15 +49,15 @@ class PaletteDialog(QtWidgets.QDialog, Ui_Dialog):
             return
 
         if not self.new_name_edit.text():
-            _ = QtWidgets.QMessageBox.warning(self, 'Error', 'New colors have no name.')
+            _ = QtWidgets.QMessageBox.warning(self, 'Error', 'New list has no name.')
             return
 
-        color_name = self.new_name_edit.text()
+        color_name = self.new_name_edit.text()  # type: str
         if color_name in self._palettes:
-            _ = QtWidgets.QMessageBox.warning(self, 'Error', 'Name already used.')
+            _ = QtWidgets.QMessageBox.warning(self, 'Error', 'Name is already used.')
             return
 
-        color_file = config_paths() / 'colorschemes.cfg'
+        color_file = config_paths() / 'colors.cfg'
 
         new_palette = []
         with color_file.open('a') as f:
@@ -66,8 +66,7 @@ class PaletteDialog(QtWidgets.QDialog, Ui_Dialog):
                 item = self.colorlist.item(i)
                 r, g, b = item.data(QtCore.Qt.DecorationRole).getRgbF()[:3]
                 new_palette.append(Colors.from_rgb(r, g, b, normed=True))
-                f.write('{r*255:.1f}, {g*255:.1f}, {b*255:.1f}\n')
+                f.write(f'{r*255:.1f}, {g*255:.1f}, {b*255:.1f}\n')
-                f.write('%.1f, %.1f}, %.1f}\n' % (r*255, g*255, b*255))
             f.write('\n')
 
         self._palettes[color_name] = new_palette

nmreval/gui_qt/lib/delegates.py

@@ -2,7 +2,7 @@ import re
 
 from ..Qt import QtWidgets, QtGui, QtCore
 
-from ...lib.colors import BaseColor, TUColors
+from ...lib.colors import BaseColor, Colors
 from ...lib.lines import LineStyle
 from ...lib.symbols import SymbolStyle, make_symbol_pixmap
 
@@ -106,7 +106,7 @@ class ColorListEditor(QtWidgets.QComboBox):
                 break
 
     def populateList(self):
-        for i, colorName in enumerate(TUColors):
+        for i, colorName in enumerate(Colors):
             color = QtGui.QColor(*colorName.value)
             self.insertItem(i, colorName.name)
             self.setItemData(i, colorName)

nmreval/gui_qt/lib/forms.py

@@ -145,9 +145,9 @@ class FormWidget(QtWidgets.QWidget):
         if self._type == 'str':
             self.vals.setText(val)
         elif self._type == 'int':
-            self.vals.setText(f'{val:.0f}')
+            self.vals.setText(f'{float(val):.0f}')
         else:
-            self.vals.setText(f'{val:.5g}')
+            self.vals.setText(f'{float(val):.5g}')
 
     def setChecked(self, enable):
         if self._checkable:

nmreval/gui_qt/lib/pg_objects.py

@@ -5,6 +5,7 @@ from pyqtgraph import (
     LinearRegionItem, mkBrush,
     mkColor, mkPen,
     PlotDataItem,
+    LegendItem,
 )
 
 from ...lib.colors import BaseColor, Colors, TUColors
@@ -438,3 +439,24 @@ class RegionItem(LinearRegionItem):
             self.prepareGeometryChange()
 
         return br
+
+
+class LegendItemBlock(LegendItem):
+    """
+    Simple subclass that stops dragging legend outside of view
+    """
+    def __init__(self, **kwargs):
+        super().__init__(**kwargs)
+        self.layout.setContentsMargins(1, 1, 1, 1)
+
+    def mouseDragEvent(self, ev):
+        if ev.button() == QtCore.Qt.LeftButton:
+            ev.accept()
+            dpos = ev.pos() - ev.lastPos()
+            vb_rect = self.parentItem().rect()
+            pos = self.pos()
+            # upper left corner and a point a little more to the bottom right must be inside
+            if vb_rect.contains(pos+dpos) and vb_rect.contains(pos+dpos+QtCore.QPointF(20., 20.)):
+                self.autoAnchor(pos + dpos)
+            else:
+                self.autoAnchor(pos)

nmreval/gui_qt/lib/utils.py

@@ -3,13 +3,13 @@ from contextlib import contextmanager
 from numpy import linspace
 from scipy.interpolate import interp1d
 
-from ..Qt import QtGui, QtWidgets
+from ..Qt import QtGui, QtWidgets, QtCore
 
 
 @contextmanager
 def busy_cursor():
     try:
-        cursor = QtGui.QCursor(QtGui.QPixmap('/autohome/dominik/Downloads/slowbro.gif'))
+        cursor = QtGui.QCursor(QtCore.Qt.ForbiddenCursor)
         QtWidgets.QApplication.setOverrideCursor(cursor)
         yield
 

nmreval/gui_qt/main/mainwindow.py

@@ -936,6 +936,12 @@ class NMRMainWindow(QtWidgets.QMainWindow, Ui_BaseWindow):
         dialog = GeneralConfiguration(self)
         dialog.show()
 
+    @QtCore.pyqtSlot(name='on_action_colorcycle_triggered')
+    def open_color_dialog(self):
+        from ..lib.color_dialog import ColorDialog
+        dialog = ColorDialog(self)
+        dialog.show()
+
     def close(self):
         write_state({'recent_path': str(self.path)})
 

nmreval/gui_qt/main/management.py

@@ -9,7 +9,7 @@ from ...fit import data as fit_d
 from ...fit.model import Model
 from ...fit.result import FitResult
 from ...fit.minimizer import FitRoutine
-from ...lib.colors import TUColorsC
+from ...lib.colors import TUColorsC, available_cycles
 from ...math.interpol import interpolate
 from ...math.logfourier import logft
 from ...math.smooth import smooth
@@ -697,10 +697,10 @@ class UpperManagement(QtCore.QObject):
             self.newData.emit(new_data, self.current_graph)
 
     @QtCore.pyqtSlot()
-    def update_color(self):
+    def set_cycle(self, set_idx: list, cycle_name: str):
-        UpperManagement._colors = cycle(TUColors)
+        col = cycle(available_cycles[cycle_name])
-        for i in self.active:
+        for s_id in set_idx:
-            self.data[i].color = next(UpperManagement._colors)
+            self.data[s_id].setColor(next(col), symbol=True, line=True, mode='all')
 
     @QtCore.pyqtSlot(dict, tuple)
     def shift_scale(self, values: dict, options: tuple):

nmreval/lib/colors.py

@@ -1,5 +1,6 @@
 import enum
 import re
+from math import atan2, cos, exp, pi, sin, sqrt
 
 from ..configs import config_paths
 
@@ -49,10 +50,11 @@ class BaseColor(enum.Enum):
         if normed:
             return hue/360, saturation, lightness
         else:
-            return hue, saturation*255, lightness*255
+            return hue, saturation*100, lightness*100
 
-    def xyz(self):
+    def xyz(self, normed=True):
         rgb = list(self.rgb(normed=True))
+
         for i, val in enumerate(rgb):
             rgb[i] = ((val+0.055)/1.055)**2.4 if val > 0.04045 else val/12.92
 
@@ -60,7 +62,10 @@ class BaseColor(enum.Enum):
         y = sum(i*j for i, j in zip([0.2126, 0.7152, 0.0722], rgb))
         z = sum(i*j for i, j in zip([0.0193, 0.1192, 0.9505], rgb))
 
+        if normed:
             return x, y, z
+        else:
+            return x*100, y*100, z*100
 
     def hsv(self, normed=False):
         r, g, b = self.rgb(normed=True)
@@ -95,17 +100,17 @@ class BaseColor(enum.Enum):
         if normed:
             return hue / 360, saturation, col_max
         else:
-            return hue, saturation * 255, col_max * 255
+            return hue, saturation * 100, col_max * 100
 
     def lab(self):
-        x, y, z = self.xyz()
+        x, y, z = self.xyz(normed=False)
         x /= 95.0489
         y /= 100
         z /= 108.884
 
-        x = x**(1 / 3) if x > 0.008856 else 7.787 * x + 16 / 116
+        x = x**(1./3.) if x > 0.008856 else 7.787 * x + 16 / 116
-        y = y**(1 / 3) if y > 0.008856 else 7.787 * y + 16 / 116
+        y = y**(1./3.) if y > 0.008856 else 7.787 * y + 16 / 116
-        z = z**(1 / 3) if z > 0.008856 else 7.787 * z + 16 / 116
+        z = z**(1./3.) if z > 0.008856 else 7.787 * z + 16 / 116
 
         l = 116 * y - 16
         a = 500 * (x - y)
@@ -127,7 +132,11 @@ class BaseColor(enum.Enum):
         if normed:
             return c, m, y, k
         else:
-            return c*255, m*255, y*255, k*255
+            return c*100, m*100, y*100, k*100
+
+    def hex(self):
+        r, g, b = self.value
+        return f'#{r:02x}{g:02x}{b:02x}'
 
     @classmethod
     def from_rgb(cls, r, g, b, normed=False):
@@ -262,6 +271,19 @@ class Tab20(BaseColor):
     TabTurquoise2 = (158, 218, 229)
 
 
+class ColorBlind(BaseColor):
+    c0 = (0, 107, 164)
+    c1 = (255, 128, 14)
+    c2 = (171, 171, 171)
+    c3 = (89, 89, 89)
+    c4 = (95, 158, 209)
+    c5 = (200, 82, 0)
+    c6 = (137, 137, 137)
+    c7 = (162, 200, 237)
+    c8 = (255, 188, 121)
+    c9 = (207, 207, 207)
+
+
 class GraceColors(BaseColor):
     Red = (255, 0, 0)
     Green = (0, 255, 0)
@@ -272,7 +294,7 @@ class GraceColors(BaseColor):
     Violet = (148, 0, 211)
     Cyan = (0, 255, 255)
     Magenta = (255, 0, 255)
-    Orange = (255, 255, 255)
+    Orange = (255, 165, 0)
     Indigo = (114, 33, 188)
     Maroon = (103, 7, 72)
     Turquoise = (64, 224, 208)
@@ -292,26 +314,107 @@ TUColors = enum.Enum(
 
 Colors = enum.Enum(
     value='Colors',
-    names={member.name: member.value for palette in [TUColors, TUGrays, GraceColors, Tab10, BlackWhite] for member in palette},
+    names={member.name: member.value for palette in [TUColors, TUGrays, GraceColors] for member in palette},
     type=BaseColor,
 )
 
 
+def ciede2000(c1: BaseColor, c2: BaseColor):
+    """
+    Calculate difference between to colors with CIEDE2000 [1]_
+
+    Args:
+        c1: Color
+        c2: Color
+
+    [1]: G. Sharma, W.Wu, E. N. Dalal: The CIEDE2000 color-difference formula:
+    Implementation notes, supplementary test data, and mathematical observations. Color (2004)
+    https://doi.org/10.1002/col.20070
+
+    """
+    l1, a1, b1 = c1.lab()
+    l2, a2, b2 = c2.lab()
+
+    l_bar = (l1 + l2) / 2
+    delta_l = l2 - l1
+
+    c1 = sqrt(a1**2 + b1**2)
+    c2 = sqrt(a2**2 + b2**2)
+    c_bar = (c1 + c2) / 2
+
+    c_scale = (1 - sqrt(c_bar**7 / (c_bar**7 + 25**7))) / 2
+    a1_prime = a1 * (1 + c_scale)
+    a2_prime = a2 * (1 + c_scale)
+
+    c1_prime = sqrt(a1_prime**2 + b1**2)
+    c2_prime = sqrt(a2_prime**2 + b2**2)
+    c_bar_prime = (c1_prime + c2_prime) / 2
+    delta_c = c2_prime - c1_prime
+
+    h1 = (atan2(b1, a1) * 180 / pi + 360) % 360
+    h2 = (atan2(b2, a2) * 180 / pi + 360) % 360
+
+    if c1_prime * c2_prime == 0:
+        dh = 0
+    else:
+        if abs(h1 - h2) <= 180:
+            dh = h2 - h1
+        else:
+            if h2 > h1:
+                dh = h2 - h1 - 360
+            else:
+                dh = h2 - h1 + 360
+
+    delta_h = 2 * sqrt(c1_prime * c2_prime) * sin(dh * pi / 360)
+
+    if c1 * c2 == 0:
+        h_bar = h1 + h2
+    else:
+        dh_abs = abs(h1 - h2)
+        h_bar = h1 + h2
+        if dh_abs > 180:
+            if h_bar < 360:
+                h_bar += 360
+            else:
+                h_bar -= 360
+        h_bar /= 2
+
+    t = 1 - 0.17 * cos((h_bar - 30) * pi / 180) + 0.25 * cos(h_bar * pi / 90) + 0.32 * cos(
+        (3 * h_bar - 6) * pi / 180) - 0.2 * cos((4 * h_bar - 63) * pi / 180)
+
+    s_l = 1 + 0.015 * (l_bar - 50)**2 / sqrt(20 + (l_bar - 50)**2)
+    s_c = 1 + 0.045 * c_bar_prime
+    s_h = 1 + 0.015 * c_bar_prime * t
+
+    r_t = -2 * sqrt(c_bar_prime**7 / (c_bar_prime**7 + 25**7)) * sin(pi / 3 * exp(-((h_bar - 275) / 25)**2))
+
+    delta_e = (delta_l / s_l)**2 + (delta_c / s_c)**2 + (delta_h / s_h)**2 + r_t * delta_c / s_c * delta_h / s_h
+
+    return sqrt(delta_e)
+
+
 def get_palettes():
     palettes = {
-        'Full': Colors,
+        'TuDa': TUColors,
         'TuDa:a': TUColorsA,
         'TuDa:b': TUColorsB,
         'TuDa:c': TUColorsC,
         'TuDa:d': TUColorsD,
-        'Tab10': Tab10,
+        'TuDa:gray': TUGrays,
-        'Grace': GraceColors
+        'Grace': GraceColors,
+        'mpl': [Colors.TuDa2b, Colors.TuDa8a, Colors.TuDa4d, Colors.TuDa9b, Colors.TuDa11a,
+                Colors.TuDa8d, Colors.TuDa10a, Colors.TuDa0a, Colors.TuDa5c, Colors.TuDa2a],
+        'colorblind': [Colors.TuDa2c, Colors.TuDa8a, Colors.TuDa0b, Colors.TuDa0d, Colors.TuDa2a,
+                       Colors.TuDa8c, Colors.TuDa0c, Colors.TuDa2b, Colors.TuDa7a, Colors.TuDa0a],
     }
 
-    with (config_paths() / 'colorschemes.cfg').open() as f:
+    user_colors = config_paths() / 'colors.cfg'
+
+    if user_colors.exists():
+        with user_colors.open() as f:
             palette_open = False
             for line in f:
-            if line.startswith('%--'):
+                if line.startswith('#--'):
                     color_name = line[4:-1]
                     palette_open = True
                     color_list = []
@@ -327,4 +430,4 @@ def get_palettes():
 
     return palettes
 
-
+available_cycles = get_palettes()

nmreval/models/usermodels.py

@@ -1,5 +1,5 @@
 import numpy as np
-from ..utils.constants import *
+from nmreval.utils.constants import *
 
 r"""
 Create user-defined fitfunctions using this template.
@@ -44,23 +44,27 @@ class Template(object):
 """
 
 
-class _Template(object):
+class Template:
     name = 'Template'
     type = 'User defined'
-    equation = r'A_{infty} x^{2} - k_{B} \beta_{1} exp(-x) + C_{\delta} + \gamma'
+    equation = r'A_{\infty} x^{2} - k_{B} \beta_{1} exp(-x) + C_{\delta} + \gamma'
-    params = [r'A_{\infty}', r'\beta_{1}']
+    params = [r'A_{\infty}', r'\beta_{1}', r'C_{\delta}']
-    bounds = [(0, None), (7, 8)]
+    bounds = [(0, None), (7, 8), (None, None)]
-    choices = [('a', {'choice 1': 'x', 'choice 2': 'inv_x'}), ('g', gamma)]
+    choices = [('name in dialog', 'c1',
+                {'Increase by': 'increase', 'Invert': 'inv_x'}),
+               ('\gamma', 'g', gamma)]
 
     @staticmethod
-    def func(p, x, a, g):
+    def func(x,
-        # p: list of fit parameters and external parameters:
+             a_inf, beta, delta,
-        #    [A_infty, beta_1, C_delta]
+             c1='inv_x', gamma=gamma['1H']):
-        # a: first choice (x or inv_x)
+
-        # g: gyromagnetic ratio of chosen nucleus (e.g. gamma['1H'])
+        if c1 == 'increase':
-        if a == 'x':
+            x = x
-            x = x
+        elif c1 == 'inv_x':
-        elif a == 'inv_x':
+            x = 1/x
-            x = 1/x
+        else:
+            x = x
+
+        return a_inf * x**2 - kB * beta * np.exp(-x) + delta + gamma
 
-        return p[0] * x**2 - kB * p[1] * np.exp(-x) + p[2] + g

resources/Default.agr

@@ -0,0 +1,333 @@
+# Grace project file
+#
+@version 50125
+@page size 841, 595
+@page scroll 5%
+@page inout 5%
+@link page off
+@map font 14 to "Charter-Regular", "Charter-Regular"
+@map font 8 to "Courier", "Courier"
+@map font 10 to "Courier-Bold", "Courier-Bold"
+@map font 11 to "Courier-BoldOblique", "Courier-BoldOblique"
+@map font 15 to "Courier-Italic", "Courier-Italic"
+@map font 9 to "Courier-Oblique", "Courier-Oblique"
+@map font 17 to "Courier-Regular", "Courier-Regular"
+@map font 19 to "Dingbats-Regular", "Dingbats-Regular"
+@map font 20 to "FrontPage-Medium", "FrontPage-Medium"
+@map font 21 to "FrontPage-Regular", "FrontPage-Regular"
+@map font 4 to "Helvetica", "Helvetica"
+@map font 6 to "Helvetica-Bold", "Helvetica-Bold"
+@map font 7 to "Helvetica-BoldOblique", "Helvetica-BoldOblique"
+@map font 5 to "Helvetica-Oblique", "Helvetica-Oblique"
+@map font 34 to "NimbusMonoL-Bold", "NimbusMonoL-Bold"
+@map font 35 to "NimbusMonoL-BoldOblique", "NimbusMonoL-BoldOblique"
+@map font 36 to "NimbusMonoL-Regular", "NimbusMonoL-Regular"
+@map font 37 to "NimbusMonoL-RegularOblique", "NimbusMonoL-RegularOblique"
+@map font 38 to "NimbusRomanNo9L-Medium", "NimbusRomanNo9L-Medium"
+@map font 39 to "NimbusRomanNo9L-MediumItalic", "NimbusRomanNo9L-MediumItalic"
+@map font 40 to "NimbusRomanNo9L-Regular", "NimbusRomanNo9L-Regular"
+@map font 41 to "NimbusRomanNo9L-RegularItalic", "NimbusRomanNo9L-RegularItalic"
+@map font 42 to "NimbusSansL-Bold", "NimbusSansL-Bold"
+@map font 43 to "NimbusSansL-BoldCondensed", "NimbusSansL-BoldCondensed"
+@map font 44 to "NimbusSansL-BoldCondensedItalic", "NimbusSansL-BoldCondensedItalic"
+@map font 45 to "NimbusSansL-BoldItalic", "NimbusSansL-BoldItalic"
+@map font 46 to "NimbusSansL-Regular", "NimbusSansL-Regular"
+@map font 47 to "NimbusSansL-RegularCondensed", "NimbusSansL-RegularCondensed"
+@map font 48 to "NimbusSansL-RegularCondensedItalic", "NimbusSansL-RegularCondensedItalic"
+@map font 49 to "NimbusSansL-RegularItalic", "NimbusSansL-RegularItalic"
+@map font 54 to "Stafford-Regular", "Stafford-Regular"
+@map font 57 to "StandardSymbolsL-Regular", "StandardSymbolsL-Regular"
+@map font 12 to "Symbol", "Symbol"
+@map font 2 to "Times-Bold", "Times-Bold"
+@map font 3 to "Times-BoldItalic", "Times-BoldItalic"
+@map font 1 to "Times-Italic", "Times-Italic"
+@map font 0 to "Times-Roman", "Times-Roman"
+@map font 64 to "URWBookmanL-DemiBold", "URWBookmanL-DemiBold"
+@map font 65 to "URWBookmanL-DemiBoldItalic", "URWBookmanL-DemiBoldItalic"
+@map font 66 to "URWBookmanL-Light", "URWBookmanL-Light"
+@map font 67 to "URWBookmanL-LightItalic", "URWBookmanL-LightItalic"
+@map font 68 to "URWChanceryL-MediumItalic", "URWChanceryL-MediumItalic"
+@map font 69 to "URWGothicL-Book", "URWGothicL-Book"
+@map font 70 to "URWGothicL-BookOblique", "URWGothicL-BookOblique"
+@map font 71 to "URWGothicL-Demi", "URWGothicL-Demi"
+@map font 72 to "URWGothicL-DemiOblique", "URWGothicL-DemiOblique"
+@map font 73 to "URWPalladioL-Bold", "URWPalladioL-Bold"
+@map font 74 to "URWPalladioL-BoldItalic", "URWPalladioL-BoldItalic"
+@map font 75 to "URWPalladioL-Italic", "URWPalladioL-Italic"
+@map font 76 to "URWPalladioL-Roman", "URWPalladioL-Roman"
+@map font 61 to "Utopia-Bold", "Utopia-Bold"
+@map font 62 to "Utopia-BoldItalic", "Utopia-BoldItalic"
+@map font 63 to "Utopia-Italic", "Utopia-Italic"
+@map font 13 to "ZapfDingbats", "ZapfDingbats"
+@map color 0 to (255, 255, 255), "white"
+@map color 1 to (0, 0, 0), "black"
+@map color 2 to (93, 133, 195), "TuDa1a"
+@map color 3 to (0, 156, 218), "TuDa2a"
+@map color 4 to (80, 182, 149), "TuDa3a"
+@map color 5 to (176, 204, 80), "TuDa4a"
+@map color 6 to (221, 223, 72), "TuDa5a"
+@map color 7 to (255, 224, 92), "TuDa6a"
+@map color 8 to (248, 186, 60), "TuDa7a"
+@map color 9 to (238, 122, 52), "TuDa8a"
+@map color 10 to (233, 80, 62), "TuDa9a"
+@map color 11 to (201, 48, 142), "TuDa10a"
+@map color 12 to (128, 69, 151), "TuDa11a"
+@map color 13 to (0, 90, 169), "TuDa1b"
+@map color 14 to (0, 130, 204), "TuDa2b"
+@map color 15 to (0, 157, 129), "TuDa3b"
+@map color 16 to (153, 192, 0), "TuDa4b"
+@map color 17 to (201, 212, 0), "TuDa5b"
+@map color 18 to (253, 202, 0), "TuDa6b"
+@map color 19 to (248, 163, 0), "TuDa7b"
+@map color 20 to (236, 101, 0), "TuDa8b"
+@map color 21 to (239, 0, 26), "TuDa9b"
+@map color 22 to (166, 0, 132), "TuDa10b"
+@map color 23 to (114, 16, 133), "TuDa11b"
+@map color 24 to (0, 78, 138), "TuDa1c"
+@map color 25 to (0, 104, 157), "TuDa2c"
+@map color 26 to (0, 136, 119), "TuDa3c"
+@map color 27 to (127, 171, 22), "TuDa4c"
+@map color 28 to (177, 189, 0), "TuDa5c"
+@map color 29 to (215, 172, 0), "TuDa6c"
+@map color 30 to (210, 135, 0), "TuDa7c"
+@map color 31 to (204, 76, 3), "TuDa8c"
+@map color 32 to (185, 15, 34), "TuDa9c"
+@map color 33 to (149, 17, 105), "TuDa10c"
+@map color 34 to (97, 28, 115), "TuDa11c"
+@map color 35 to (36, 53, 114), "TuDa1d"
+@map color 36 to (0, 78, 115), "TuDa2d"
+@map color 37 to (0, 113, 94), "TuDa3d"
+@map color 38 to (106, 139, 55), "TuDa4d"
+@map color 39 to (153, 166, 4), "TuDa5d"
+@map color 40 to (174, 142, 0), "TuDa6d"
+@map color 41 to (190, 111, 0), "TuDa7d"
+@map color 42 to (169, 73, 19), "TuDa8d"
+@map color 43 to (188, 28, 38), "TuDa9d"
+@map color 44 to (115, 32, 84), "TuDa10d"
+@map color 45 to (76, 34, 106), "TuDa11d"
+@map color 46 to (220, 220, 220), "TuDa0a"
+@map color 47 to (181, 181, 181), "TuDa0b"
+@map color 48 to (137, 137, 137), "TuDa0c"
+@map color 49 to (83, 83, 83), "TuDa0d"
+@map color 50 to (255, 0, 0), "red"
+@map color 51 to (0, 255, 0), "green"
+@map color 52 to (0, 0, 255), "blue"
+@map color 53 to (255, 255, 0), "yellow"
+@map color 54 to (188, 143, 143), "brown"
+@map color 55 to (148, 0, 211), "violet"
+@map color 56 to (0, 255, 255), "cyan"
+@map color 57 to (255, 0, 255), "magenta"
+@map color 58 to (255, 165, 0), "orange"
+@map color 59 to (114, 33, 188), "indigo"
+@map color 60 to (103, 7, 72), "maroon"
+@map color 61 to (64, 224, 208), "turquoise"
+@map color 62 to (0, 139, 0), "green4"
+@reference date 0
+@date wrap off
+@date wrap year 1950
+@default linewidth 1.0
+@default linestyle 1
+@default color 1
+@default pattern 1
+@default font 0
+@default char size 1.000000
+@default symbol size 1.000000
+@default sformat "%.8g"
+@background color 0
+@page background fill on
+@timestamp off
+@timestamp 0.03, 0.03
+@timestamp color 1
+@timestamp rot 0
+@timestamp font 0
+@timestamp char size 1.000000
+@timestamp def "Thu Apr 14 17:47:29 2022"
+@r0 off
+@link r0 to g0
+@r0 type above
+@r0 linestyle 1
+@r0 linewidth 1.0
+@r0 color 1
+@r0 line 0, 0, 0, 0
+@r1 off
+@link r1 to g0
+@r1 type above
+@r1 linestyle 1
+@r1 linewidth 1.0
+@r1 color 1
+@r1 line 0, 0, 0, 0
+@r2 off
+@link r2 to g0
+@r2 type above
+@r2 linestyle 1
+@r2 linewidth 1.0
+@r2 color 1
+@r2 line 0, 0, 0, 0
+@r3 off
+@link r3 to g0
+@r3 type above
+@r3 linestyle 1
+@r3 linewidth 1.0
+@r3 color 1
+@r3 line 0, 0, 0, 0
+@r4 off
+@link r4 to g0
+@r4 type above
+@r4 linestyle 1
+@r4 linewidth 1.0
+@r4 color 1
+@r4 line 0, 0, 0, 0
+@g0 on
+@g0 hidden false
+@g0 type XY
+@g0 stacked false
+@g0 bar hgap 0.000000
+@g0 fixedpoint off
+@g0 fixedpoint type 0
+@g0 fixedpoint xy 0.000000, 0.000000
+@g0 fixedpoint format general general
+@g0 fixedpoint prec 6, 6
+@with g0
+@    world 0, 0, 1, 1
+@    stack world 0, 0, 0, 0
+@    znorm 1
+@    view 0.150000, 0.120000, 1.314214, 0.870000
+@    title ""
+@    title font 4
+@    title size 1.250000
+@    title color 1
+@    subtitle ""
+@    subtitle font 4
+@    subtitle size 1.250000
+@    subtitle color 1
+@    xaxes scale Normal
+@    yaxes scale Normal
+@    xaxes invert off
+@    yaxes invert off
+@    xaxis  on
+@    xaxis  type zero false
+@    xaxis  offset 0.000000 , 0.000000
+@    xaxis  bar on
+@    xaxis  bar color 1
+@    xaxis  bar linestyle 1
+@    xaxis  bar linewidth 2.0
+@    xaxis  label ""
+@    xaxis  label layout para
+@    xaxis  label place auto
+@    xaxis  label char size 1.250000
+@    xaxis  label font 4
+@    xaxis  label color 1
+@    xaxis  label place normal
+@    xaxis  tick on
+@    xaxis  tick major 0.2
+@    xaxis  tick minor ticks 1
+@    xaxis  tick default 6
+@    xaxis  tick place rounded true
+@    xaxis  tick in
+@    xaxis  tick major size 1.000000
+@    xaxis  tick major color 1
+@    xaxis  tick major linewidth 1.5
+@    xaxis  tick major linestyle 1
+@    xaxis  tick major grid off
+@    xaxis  tick minor color 1
+@    xaxis  tick minor linewidth 1.5
+@    xaxis  tick minor linestyle 1
+@    xaxis  tick minor grid off
+@    xaxis  tick minor size 0.500000
+@    xaxis  ticklabel on
+@    xaxis  ticklabel format general
+@    xaxis  ticklabel prec 5
+@    xaxis  ticklabel formula ""
+@    xaxis  ticklabel append ""
+@    xaxis  ticklabel prepend ""
+@    xaxis  ticklabel angle 0
+@    xaxis  ticklabel skip 0
+@    xaxis  ticklabel stagger 0
+@    xaxis  ticklabel place normal
+@    xaxis  ticklabel offset auto
+@    xaxis  ticklabel offset 0.000000 , 0.010000
+@    xaxis  ticklabel start type auto
+@    xaxis  ticklabel start 0.000000
+@    xaxis  ticklabel stop type auto
+@    xaxis  ticklabel stop 0.000000
+@    xaxis  ticklabel char size 1.250000
+@    xaxis  ticklabel font 4
+@    xaxis  ticklabel color 1
+@    xaxis  tick place both
+@    xaxis  tick spec type none
+@    yaxis  on
+@    yaxis  type zero false
+@    yaxis  offset 0.000000 , 0.000000
+@    yaxis  bar on
+@    yaxis  bar color 1
+@    yaxis  bar linestyle 1
+@    yaxis  bar linewidth 2.0
+@    yaxis  label ""
+@    yaxis  label layout para
+@    yaxis  label place auto
+@    yaxis  label char size 1.250000
+@    yaxis  label font 4
+@    yaxis  label color 1
+@    yaxis  label place normal
+@    yaxis  tick on
+@    yaxis  tick major 0.2
+@    yaxis  tick minor ticks 1
+@    yaxis  tick default 6
+@    yaxis  tick place rounded true
+@    yaxis  tick in
+@    yaxis  tick major size 1.000000
+@    yaxis  tick major color 1
+@    yaxis  tick major linewidth 1.5
+@    yaxis  tick major linestyle 1
+@    yaxis  tick major grid off
+@    yaxis  tick minor color 1
+@    yaxis  tick minor linewidth 1.5
+@    yaxis  tick minor linestyle 1
+@    yaxis  tick minor grid off
+@    yaxis  tick minor size 0.500000
+@    yaxis  ticklabel on
+@    yaxis  ticklabel format general
+@    yaxis  ticklabel prec 5
+@    yaxis  ticklabel formula ""
+@    yaxis  ticklabel append ""
+@    yaxis  ticklabel prepend ""
+@    yaxis  ticklabel angle 0
+@    yaxis  ticklabel skip 0
+@    yaxis  ticklabel stagger 0
+@    yaxis  ticklabel place normal
+@    yaxis  ticklabel offset auto
+@    yaxis  ticklabel offset 0.000000 , 0.010000
+@    yaxis  ticklabel start type auto
+@    yaxis  ticklabel start 0.000000
+@    yaxis  ticklabel stop type auto
+@    yaxis  ticklabel stop 0.000000
+@    yaxis  ticklabel char size 1.250000
+@    yaxis  ticklabel font 4
+@    yaxis  ticklabel color 1
+@    yaxis  tick place both
+@    yaxis  tick spec type none
+@    altxaxis  off
+@    altyaxis  off
+@    legend on
+@    legend loctype view
+@    legend 0.8, 0.8
+@    legend box color 1
+@    legend box pattern 1
+@    legend box linewidth 1.0
+@    legend box linestyle 0
+@    legend box fill color 0
+@    legend box fill pattern 1
+@    legend font 4
+@    legend char size 1.250000
+@    legend color 1
+@    legend length 4
+@    legend vgap 1
+@    legend hgap 1
+@    legend invert false
+@    frame type 0
+@    frame linestyle 1
+@    frame linewidth 1.5
+@    frame color 1
+@    frame pattern 1
+@    frame background color 0
+@    frame background pattern 0

resources/_ui/basewindow.ui

@@ -250,7 +250,7 @@
     </property>
     <addaction name="actionMouse_behaviour"/>
     <addaction name="separator"/>
-    <addaction name="actionGrace_preferences"/>
+    <addaction name="action_colorcycle"/>
     <addaction name="actionConfiguration"/>
    </widget>
    <widget class="QMenu" name="menuWindow">
@@ -665,9 +665,9 @@
     <string>&amp;Create fit function...</string>
    </property>
   </action>
-  <action name="actionGrace_preferences">
+  <action name="action_colorcycle">
    <property name="text">
-    <string>&amp;Grace preferences...</string>
+    <string>Color cycles...</string>
    </property>
   </action>
   <action name="actionSave_session">

resources/_ui/color_palette.ui

@@ -11,30 +11,25 @@
    </rect>
   </property>
   <property name="windowTitle">
-   <string>Color Palette</string>
+   <string>Color cycles</string>
   </property>
   <layout class="QGridLayout" name="gridLayout">
-   <item row="2" column="0">
+   <property name="leftMargin">
-    <widget class="QPushButton" name="append_palette_button">
+    <number>3</number>
-     <property name="text">
-      <string>Append</string>
    </property>
-    </widget>
+   <property name="topMargin">
-   </item>
+    <number>3</number>
-   <item row="4" column="0">
-    <spacer name="verticalSpacer">
-     <property name="orientation">
-      <enum>Qt::Vertical</enum>
    </property>
-     <property name="sizeHint" stdset="0">
+   <property name="rightMargin">
-      <size>
+    <number>3</number>
-       <width>20</width>
-       <height>40</height>
-      </size>
    </property>
-    </spacer>
+   <property name="bottomMargin">
-   </item>
+    <number>3</number>
-   <item row="0" column="0">
+   </property>
+   <property name="spacing">
+    <number>3</number>
+   </property>
+   <item row="0" column="1" colspan="2">
     <widget class="QComboBox" name="palette_combobox">
      <property name="sizePolicy">
       <sizepolicy hsizetype="MinimumExpanding" vsizetype="Fixed">
@@ -44,7 +39,7 @@
      </property>
     </widget>
    </item>
-   <item row="6" column="0">
+   <item row="3" column="2">
     <widget class="QPushButton" name="add_color_button">
      <property name="sizePolicy">
       <sizepolicy hsizetype="MinimumExpanding" vsizetype="Fixed">
@@ -57,34 +52,7 @@
      </property>
     </widget>
    </item>
-   <item row="5" column="0">
+   <item row="4" column="1" colspan="2">
-    <widget class="ColorListEditor" name="color_combobox">
-     <property name="sizePolicy">
-      <sizepolicy hsizetype="MinimumExpanding" vsizetype="Fixed">
-       <horstretch>0</horstretch>
-       <verstretch>0</verstretch>
-      </sizepolicy>
-     </property>
-    </widget>
-   </item>
-   <item row="9" column="1">
-    <widget class="QPushButton" name="save_button">
-     <property name="text">
-      <string>Save as new list</string>
-     </property>
-    </widget>
-   </item>
-   <item row="1" column="0">
-    <widget class="QPushButton" name="add_palette_button">
-     <property name="text">
-      <string>Load</string>
-     </property>
-    </widget>
-   </item>
-   <item row="9" column="2">
-    <widget class="QLineEdit" name="new_name_edit"/>
-   </item>
-   <item row="0" column="1" rowspan="9" colspan="2">
     <widget class="QListWidget" name="colorlist">
      <property name="sizePolicy">
       <sizepolicy hsizetype="Expanding" vsizetype="Expanding">
@@ -97,7 +65,17 @@
      </property>
     </widget>
    </item>
-   <item row="10" column="0" colspan="3">
+   <item row="1" column="1">
+    <widget class="QPushButton" name="add_palette_button">
+     <property name="text">
+      <string>Load</string>
+     </property>
+    </widget>
+   </item>
+   <item row="6" column="1" colspan="2">
+    <widget class="QLineEdit" name="new_name_edit"/>
+   </item>
+   <item row="7" column="0" colspan="3">
     <widget class="QDialogButtonBox" name="buttonBox">
      <property name="orientation">
       <enum>Qt::Horizontal</enum>
@@ -107,6 +85,64 @@
      </property>
     </widget>
    </item>
+   <item row="3" column="1">
+    <widget class="ColorListEditor" name="color_combobox">
+     <property name="sizePolicy">
+      <sizepolicy hsizetype="MinimumExpanding" vsizetype="Fixed">
+       <horstretch>0</horstretch>
+       <verstretch>0</verstretch>
+      </sizepolicy>
+     </property>
+    </widget>
+   </item>
+   <item row="2" column="0" colspan="3">
+    <widget class="Line" name="line">
+     <property name="orientation">
+      <enum>Qt::Horizontal</enum>
+     </property>
+    </widget>
+   </item>
+   <item row="6" column="0">
+    <widget class="QPushButton" name="save_button">
+     <property name="text">
+      <string>Save as new list</string>
+     </property>
+    </widget>
+   </item>
+   <item row="0" column="0">
+    <widget class="QLabel" name="label">
+     <property name="text">
+      <string>Color cycles</string>
+     </property>
+     <property name="buddy">
+      <cstring>palette_combobox</cstring>
+     </property>
+    </widget>
+   </item>
+   <item row="1" column="2">
+    <widget class="QPushButton" name="append_palette_button">
+     <property name="text">
+      <string>Append</string>
+     </property>
+    </widget>
+   </item>
+   <item row="3" column="0">
+    <widget class="QLabel" name="label_2">
+     <property name="text">
+      <string>Available color</string>
+     </property>
+     <property name="buddy">
+      <cstring>color_combobox</cstring>
+     </property>
+    </widget>
+   </item>
+   <item row="5" column="0" colspan="3">
+    <widget class="Line" name="line_2">
+     <property name="orientation">
+      <enum>Qt::Horizontal</enum>
+     </property>
+    </widget>
+   </item>
   </layout>
  </widget>
  <customwidgets>