| 1 | #!/usr/bin/env python3 |
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| 2 | # -*- coding: utf-8 -*- |
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| 3 | #--------------------------------------------------------------------------------# |
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| 4 | # This file is part of the PALM model system. |
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| 5 | # |
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| 6 | # PALM is free software: you can redistribute it and/or modify it under the terms |
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| 7 | # of the GNU General Public License as published by the Free Software Foundation, |
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| 8 | # either version 3 of the License, or (at your option) any later version. |
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| 9 | # |
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| 10 | # PALM is distributed in the hope that it will be useful, but WITHOUT ANY |
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| 11 | # WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR |
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| 12 | # A PARTICULAR PURPOSE. See the GNU General Public License for more details. |
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| 13 | # |
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| 14 | # You should have received a copy of the GNU General Public License along with |
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| 15 | # PALM. If not, see <http://www.gnu.org/licenses/>. |
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| 16 | # |
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| 17 | # Copyright 1997-2021 Leibniz Universitaet Hannover |
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| 18 | #--------------------------------------------------------------------------------# |
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| 19 | # |
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| 20 | # Current revisions: |
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| 21 | # ----------------- |
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| 22 | # |
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| 23 | # |
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| 24 | # Former revisions: |
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| 25 | # ----------------- |
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| 26 | # $Id: palm_gf 4869 2021-02-08 16:14:27Z gronemeier $ |
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| 27 | # Modified palm_gf using python3 (edited by JR and RM) |
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| 28 | # |
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| 29 | # 4843 2021-01-15 15:22:11Z schwenkel |
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| 30 | # Removed PALM_BIN dependency |
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| 31 | # |
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| 32 | # 2825 2018-02-20 21:48:27Z maronga |
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| 33 | # Modified header |
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| 34 | # |
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| 35 | # 2718 2018-01-02 08:49:38Z maronga |
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| 36 | # Corrected "Former revisions" section |
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| 37 | # |
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| 38 | # 2696 2017-12-14 17:12:51Z kanani |
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| 39 | # Change in file header (GPL part) |
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| 40 | # |
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| 41 | # 2309 2017-07-10 15:55:55Z gronemeier |
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| 42 | # some further bugfixes for palm_gf |
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| 43 | # |
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| 44 | # 2308 2017-07-10 12:15:43Z gronemeier |
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| 45 | # new version of palm_gf (bugfixes, changes and new options) |
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| 46 | # |
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| 47 | # 2116 2017-01-16 16:15:24Z maronga |
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| 48 | # Initial revision |
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| 49 | # |
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| 50 | # |
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| 51 | # |
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| 52 | # Description: |
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| 53 | # ------------ |
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| 54 | # |
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| 55 | # |
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| 56 | # Instructions: |
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| 57 | # ------------- |
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| 58 | # |
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| 59 | #------------------------------------------------------------------------------! |
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| 60 | |
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| 61 | from PyQt5 import QtWidgets, uic |
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| 62 | from PyQt5.QtWidgets import QDesktopWidget |
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| 63 | from palm_gf_files.palm_gf_conf import cfg_write, cfg_read |
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| 64 | import sys |
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| 65 | import os |
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| 66 | from palm_gf_files.palm_gf_exec import MyThread |
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| 67 | from palm_gf_files.palm_gf_tools import MyTable |
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| 68 | |
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| 69 | try: |
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| 70 | devnull = open(os.devnull, 'w') |
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| 71 | palm_dir = os.getcwd() |
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| 72 | palm_bin = palm_dir + '/trunk/SCRIPTS' |
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| 73 | job_dir = palm_dir + '/JOBS' |
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| 74 | user_dir = palm_dir + '/USER_CODE' |
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| 75 | with open(palm_bin + '/palmrungui', 'r') as fh: |
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| 76 | # file found |
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| 77 | out = None |
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| 78 | except: |
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| 79 | print ('Error. palm_gf probably called in wrong directory.') |
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| 80 | raise SystemExit |
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| 81 | |
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| 82 | class AppMain(QtWidgets.QMainWindow): |
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| 83 | def __init__(self): |
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| 84 | super(AppMain, self).__init__() |
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| 85 | uic.loadUi(palm_bin + '/palm_gf_files/palm_gf.ui', self) |
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| 86 | self.center_window() |
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| 87 | |
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| 88 | |
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| 89 | # initial hiding of results ui elements |
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| 90 | self.result_visibility(False) |
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| 91 | # dis/enable ui elements when un/checked |
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| 92 | self.strict_matching_check.stateChanged.connect(self.strict_matching_able) |
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| 93 | self.npex_npey_ratio_check.stateChanged.connect(self.npex_npey_ratio_able) |
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| 94 | self.nx_ny_ratio_check.stateChanged.connect(self.nx_ny_ratio_able) |
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| 95 | self.psolver_combo_box.currentIndexChanged.connect(self.fft_method_able) |
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| 96 | # loading last used values into ui |
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| 97 | self.startup_values() |
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| 98 | # making sure max is not less than min |
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| 99 | self.nx_min_box.valueChanged.connect(self.input_min_max_check) |
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| 100 | self.ny_min_box.valueChanged.connect(self.input_min_max_check) |
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| 101 | self.nz_min_box.valueChanged.connect(self.input_min_max_check) |
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| 102 | self.proc_min_box.valueChanged.connect(self.input_min_max_check) |
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| 103 | # connects main buttons to subroutines |
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| 104 | self.start_button.clicked.connect(self.initialize) |
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| 105 | self.view_button.clicked.connect(self.load_table) |
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| 106 | self.reset_button.clicked.connect(self.reset_values) |
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| 107 | |
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| 108 | def load_table(self): |
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| 109 | # opens table Ui |
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| 110 | self.table = MyTable() |
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| 111 | self.table.show() |
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| 112 | |
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| 113 | def initialize(self): |
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| 114 | # translating Ui input into checks used during calculation |
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| 115 | if self.psolver_combo_box.currentIndex() != 0: |
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| 116 | if self.psolver_combo_box.currentIndex() == 1: |
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| 117 | poisfft = True |
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| 118 | switch = True |
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| 119 | if self.fft_combo_box.currentIndex() == 2: |
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| 120 | temperton = True |
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| 121 | else: |
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| 122 | temperton = False |
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| 123 | else: |
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| 124 | poisfft = False |
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| 125 | temperton = False |
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| 126 | switch = False |
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| 127 | |
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| 128 | if self.psolver_combo_box.currentIndex() == 2: |
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| 129 | multigrid = True |
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| 130 | else: |
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| 131 | multigrid = False |
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| 132 | |
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| 133 | if self.spectra_box.checkState() == 2: |
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| 134 | spectra = True |
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| 135 | poisfft = True |
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| 136 | else: |
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| 137 | spectra = False |
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| 138 | |
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| 139 | if self.nx_ny_ratio_check.checkState() == 2: |
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| 140 | dnxny = self.nx_ny_ratio_box.value() |
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| 141 | else: |
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| 142 | dnxny = 0 |
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| 143 | |
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| 144 | if self.npex_npey_ratio_check.checkState() == 2: |
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| 145 | dpxpy = self.npex_npey_ratio_box.value() |
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| 146 | dpxpy_dev = self.npex_npey_deviation_box.value() |
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| 147 | else: |
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| 148 | dpxpy = 0 |
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| 149 | dpxpy_dev = 0 |
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| 150 | |
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| 151 | if self.strict_matching_check.checkState() == 2: |
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| 152 | tpn = self.strict_matching_box.value() |
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| 153 | else: |
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| 154 | tpn = 0 |
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| 155 | |
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| 156 | # writing the config |
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| 157 | cfg_write(self.nx_min_box.value(), self.nx_max_box.value(), self.ny_min_box.value(), |
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| 158 | self.ny_max_box.value(), self.nz_min_box.value(), self.nz_max_box.value(), |
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| 159 | self.proc_min_box.value(), self.proc_max_box.value(), tpn, |
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| 160 | poisfft, switch, temperton, multigrid, spectra, dnxny, dpxpy, dpxpy_dev) |
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| 161 | |
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| 162 | self.progressbar.setVisible(True) |
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| 163 | self.progressbar.setValue(0) |
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| 164 | # connects PyQtsignals to subroutines |
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| 165 | self.thread = MyThread() |
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| 166 | self.thread.change_value.connect(self.setprogressval) |
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| 167 | self.thread.completed.connect(self.result_label_update) |
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| 168 | self.thread.busy.connect(self.info_label_update) |
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| 169 | # starts thread to calculate |
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| 170 | self.thread.start() |
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| 171 | |
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| 172 | def info_label_update(self): |
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| 173 | # standby information during search of the limits of all results |
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| 174 | self.results_information_label.setText('Standby please.') |
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| 175 | self.results_information_label.setVisible(True) |
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| 176 | |
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| 177 | def result_label_update(self, counter, timer): |
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| 178 | self.result_visibility(True) |
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| 179 | self.progressbar.setVisible(False) |
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| 180 | if int(timer) == 0: |
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| 181 | self.results_information_label.setText('Success! Gridfinder found ' + str(counter) + |
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| 182 | ' results in less than 1 second.') |
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| 183 | else: |
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| 184 | self.results_information_label.setText('Success! Gridfinder found ' + str(counter) + |
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| 185 | ' results in ' + str(timer) + ' seconds.') |
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| 186 | |
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| 187 | def setprogressval(self, val): |
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| 188 | # updates the value of the progressbar, data received from PyQtsignal |
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| 189 | self.progressbar.setValue(val) |
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| 190 | |
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| 191 | def startup_values(self): |
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| 192 | # reads the .ini and updates default values to last used values |
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| 193 | if os.path.exists('./palm_gf_config.ini') is False: |
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| 194 | pass |
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| 195 | else: |
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| 196 | value_list = cfg_read() |
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| 197 | self.nx_min_box.setValue(int(value_list[0])) |
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| 198 | self.nx_max_box.setValue(int(value_list[1])) |
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| 199 | self.ny_min_box.setValue(int(value_list[2])) |
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| 200 | self.ny_max_box.setValue(int(value_list[3])) |
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| 201 | self.nz_min_box.setValue(int(value_list[4])) |
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| 202 | self.nz_max_box.setValue(int(value_list[5])) |
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| 203 | self.proc_min_box.setValue(int(value_list[6])) |
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| 204 | self.proc_max_box.setValue(int(value_list[7])) |
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| 205 | if int(value_list[8]) != 0: |
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| 206 | self.strict_matching_check.setCheckState(2) |
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| 207 | self.strict_matching_box.setValue(int(value_list[8])) |
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| 208 | if float(value_list[9]) != 0: |
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| 209 | self.nx_ny_ratio_check.setCheckState(2) |
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| 210 | self.nx_ny_ratio_box.setValue(float(value_list[9])) |
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| 211 | if float(value_list[10]) != 0: |
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| 212 | self.npex_npey_ratio_check.setCheckState(2) |
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| 213 | self.npex_npey_ratio_box.setValue(float(value_list[10])) |
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| 214 | self.npex_npey_deviation_box.setValue(float(value_list[11])) |
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| 215 | |
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| 216 | def reset_values(self): |
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| 217 | # resets values to default, does not update .ini |
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| 218 | self.nx_min_box.setValue(0) |
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| 219 | self.nx_max_box.setValue(1) |
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| 220 | self.ny_min_box.setValue(0) |
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| 221 | self.ny_max_box.setValue(1) |
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| 222 | self.nz_min_box.setValue(0) |
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| 223 | self.nz_max_box.setValue(1) |
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| 224 | self.proc_min_box.setValue(0) |
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| 225 | self.proc_max_box.setValue(1) |
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| 226 | self.strict_matching_check.setCheckState(0) |
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| 227 | self.nx_ny_ratio_check.setCheckState(0) |
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| 228 | self.nx_ny_ratio_box.setValue(1.00) |
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| 229 | self.npex_npey_ratio_check.setCheckState(0) |
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| 230 | self.npex_npey_ratio_box.setValue(1.00) |
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| 231 | self.npex_npey_deviation_box.setValue(1) |
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| 232 | |
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| 233 | def input_min_max_check(self): |
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| 234 | # setting chosen min values as minimum of maxima |
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| 235 | self.nx_max_box.setMinimum(self.nx_min_box.value()) |
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| 236 | self.ny_max_box.setMinimum(self.ny_min_box.value()) |
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| 237 | self.nz_max_box.setMinimum(self.nz_min_box.value()) |
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| 238 | self.proc_max_box.setMinimum(self.proc_min_box.value()) |
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| 239 | |
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| 240 | def center_window(self): |
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| 241 | # moving window to middle of the screen |
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| 242 | frame = self.frameGeometry() |
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| 243 | center = QDesktopWidget().availableGeometry().center() |
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| 244 | frame.moveCenter(center) |
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| 245 | self.move(frame.topLeft()) |
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| 246 | |
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| 247 | def fft_method_able(self): |
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| 248 | # enable/disable QComboBox of fft method |
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| 249 | if self.psolver_combo_box.currentIndex() == 1: |
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| 250 | self.fft_combo_box.setEnabled(True) |
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| 251 | else: |
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| 252 | self.fft_combo_box.setEnabled(False) |
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| 253 | self.fft_combo_box.setCurrentIndex(0) |
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| 254 | |
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| 255 | def nx_ny_ratio_able(self): |
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| 256 | # enable/disable QSpinBox of nx/ny-ratio |
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| 257 | if int(self.nx_ny_ratio_check.checkState()) == 0: |
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| 258 | self.nx_ny_ratio_box.setEnabled(False) |
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| 259 | else: |
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| 260 | self.nx_ny_ratio_box.setEnabled(True) |
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| 261 | |
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| 262 | def strict_matching_able(self): |
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| 263 | # enable/disable QSpinBox of strict matching |
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| 264 | if int(self.strict_matching_check.checkState()) == 0: |
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| 265 | self.strict_matching_box.setEnabled(False) |
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| 266 | else: |
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| 267 | self.strict_matching_box.setEnabled(True) |
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| 268 | |
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| 269 | def npex_npey_ratio_able(self): |
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| 270 | # enable/disable UI elements of npex/npey-ratio |
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| 271 | if int(self.npex_npey_ratio_check.checkState()) == 0: |
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| 272 | self.npex_npey_ratio_box.setEnabled(False) |
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| 273 | self.npex_npey_deviation_slider.setEnabled(False) |
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| 274 | self.npex_npey_deviation_box.setEnabled(False) |
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| 275 | else: |
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| 276 | self.npex_npey_ratio_box.setEnabled(True) |
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| 277 | self.npex_npey_deviation_slider.setEnabled(True) |
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| 278 | self.npex_npey_deviation_box.setEnabled(True) |
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| 279 | |
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| 280 | def result_visibility(self, boolean): |
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| 281 | # making certain ui elements in/visible |
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| 282 | self.progressbar.setVisible(boolean) |
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| 283 | self.results_information_label.setVisible(boolean) |
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| 284 | self.view_button.setVisible(boolean) |
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| 285 | |
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| 286 | |
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| 287 | if __name__ == "__main__": |
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| 288 | app = QtWidgets.QApplication(sys.argv) |
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| 289 | window = AppMain() |
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| 290 | window.setWindowTitle('palm_gf') |
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| 291 | window.show() |
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| 292 | sys.exit(app.exec_()) |
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