385 lines
11 KiB
XML
385 lines
11 KiB
XML
<?xml version="1.0" encoding="UTF-8"?>
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<ui version="4.0">
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<class>Form</class>
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<widget class="QWidget" name="Form">
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<property name="geometry">
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<rect>
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<x>0</x>
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<y>0</y>
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<width>354</width>
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<height>329</height>
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</rect>
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</property>
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<property name="windowTitle">
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<string notr="true">Save Molecule</string>
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</property>
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<layout class="QVBoxLayout" name="verticalLayout">
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<item>
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<layout class="QGridLayout" name="gridLayout">
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<item row="0" column="1">
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<widget class="QComboBox" name="input_selection">
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<property name="sizePolicy">
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<sizepolicy hsizetype="Expanding" vsizetype="Fixed">
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<horstretch>0</horstretch>
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<verstretch>0</verstretch>
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</sizepolicy>
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</property>
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<property name="editable">
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<bool>true</bool>
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</property>
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<item>
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<property name="text">
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<string notr="true">enabled</string>
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</property>
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</item>
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<item>
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<property name="text">
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<string notr="true">all</string>
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</property>
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</item>
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</widget>
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</item>
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<item row="1" column="1">
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<widget class="QComboBox" name="input_state">
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<property name="sizePolicy">
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<sizepolicy hsizetype="Fixed" vsizetype="Fixed">
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<horstretch>0</horstretch>
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<verstretch>0</verstretch>
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</sizepolicy>
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</property>
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<property name="minimumSize">
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<size>
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<width>100</width>
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<height>0</height>
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</size>
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</property>
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<item>
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<property name="text">
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<string notr="true">-1 (current)</string>
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</property>
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</item>
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<item>
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<property name="text">
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<string notr="true">0 (all states)</string>
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</property>
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</item>
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</widget>
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</item>
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<item row="0" column="0">
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<widget class="QLabel" name="label_2">
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<property name="text">
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<string notr="true">Se&lection</string>
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</property>
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<property name="buddy">
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<cstring>input_selection</cstring>
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</property>
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</widget>
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</item>
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<item row="1" column="0">
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<widget class="QLabel" name="label">
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<property name="text">
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<string notr="true">S&tate</string>
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</property>
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<property name="buddy">
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<cstring>input_state</cstring>
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</property>
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</widget>
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</item>
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</layout>
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</item>
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<item>
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<widget class="QTabWidget" name="tabWidget">
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<property name="currentIndex">
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<number>0</number>
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</property>
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<widget class="QWidget" name="tab_3">
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<attribute name="title">
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<string notr="true">Generic Options</string>
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</attribute>
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<layout class="QVBoxLayout" name="verticalLayout_4">
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<property name="leftMargin">
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<number>8</number>
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</property>
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<property name="topMargin">
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<number>8</number>
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</property>
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<property name="rightMargin">
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<number>8</number>
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</property>
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<property name="bottomMargin">
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<number>8</number>
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</property>
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<item>
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<widget class="QCheckBox" name="input_retain_order">
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<property name="toolTip">
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<string notr="true">retain_order</string>
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</property>
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<property name="text">
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<string notr="true">Original atom order (according to "rank")</string>
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</property>
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</widget>
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</item>
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<item>
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<spacer name="verticalSpacer">
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<property name="orientation">
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<enum>Qt::Vertical</enum>
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</property>
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<property name="sizeHint" stdset="0">
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<size>
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<width>20</width>
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<height>40</height>
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</size>
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</property>
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</spacer>
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</item>
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</layout>
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</widget>
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<widget class="QWidget" name="tab_4">
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<attribute name="title">
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<string notr="true">PDB Options</string>
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</attribute>
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<layout class="QVBoxLayout" name="verticalLayout_2">
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<property name="leftMargin">
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<number>8</number>
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</property>
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<property name="topMargin">
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<number>8</number>
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</property>
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<property name="rightMargin">
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<number>8</number>
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</property>
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<property name="bottomMargin">
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<number>8</number>
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</property>
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<item>
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<widget class="QCheckBox" name="input_no_pdb_conect_nodup">
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<property name="toolTip">
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<string notr="true">pdb_conect_nodup</string>
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</property>
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<property name="text">
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<string notr="true">Write multiple bonds as duplicate CONECT records</string>
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</property>
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</widget>
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</item>
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<item>
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<widget class="QCheckBox" name="input_pdb_conect_all">
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<property name="toolTip">
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<string notr="true">pdb_conect_all</string>
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</property>
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<property name="text">
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<string notr="true">Write CONECT records for all bonds</string>
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</property>
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</widget>
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</item>
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<item>
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<widget class="QCheckBox" name="input_no_ignore_pdb_segi">
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<property name="toolTip">
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<string notr="true">ignore_pdb_segi</string>
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</property>
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<property name="text">
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<string notr="true">Write segment identifier (segi) column</string>
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</property>
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</widget>
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</item>
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<item>
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<widget class="QCheckBox" name="input_pdb_retain_ids">
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<property name="toolTip">
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<string notr="true">pdb_retain_ids</string>
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</property>
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<property name="text">
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<string notr="true">Retain atom ids</string>
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</property>
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</widget>
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</item>
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<item>
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<widget class="QCheckBox" name="input_multisave">
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<property name="toolTip">
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<string notr="true">use "multisave" command</string>
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</property>
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<property name="text">
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<string notr="true">Write HEADER for every object</string>
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</property>
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</widget>
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</item>
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<item>
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<spacer name="verticalSpacer_2">
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<property name="orientation">
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<enum>Qt::Vertical</enum>
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</property>
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<property name="sizeHint" stdset="0">
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<size>
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<width>20</width>
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<height>40</height>
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</size>
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</property>
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</spacer>
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</item>
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</layout>
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</widget>
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<widget class="QWidget" name="tab">
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<attribute name="title">
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<string notr="true">Multi-File</string>
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</attribute>
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<layout class="QGridLayout" name="gridLayout_3">
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<property name="leftMargin">
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<number>8</number>
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</property>
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<property name="topMargin">
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<number>8</number>
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</property>
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<property name="rightMargin">
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<number>8</number>
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</property>
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<property name="bottomMargin">
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<number>8</number>
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</property>
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<item row="0" column="0" colspan="2">
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<widget class="QLabel" name="label_3">
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<property name="text">
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<string notr="true">Write objects or states to ...</string>
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</property>
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</widget>
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</item>
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<item row="1" column="0">
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<widget class="QRadioButton" name="input_multi_off">
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<property name="text">
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<string notr="true">one single f&ile</string>
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</property>
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<property name="checked">
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<bool>true</bool>
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</property>
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</widget>
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</item>
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<item row="2" column="0">
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<widget class="QRadioButton" name="input_multi_object">
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<property name="text">
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<string notr="true">one file per ob&ject</string>
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</property>
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</widget>
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</item>
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<item row="2" column="1">
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<widget class="QLineEdit" name="input_multi_object_fmt">
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<property name="enabled">
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<bool>false</bool>
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</property>
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<property name="toolTip">
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<string notr="true">Placeholders:
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{name} - object name
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{state} - state number
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{title} - state title
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{num} - running number</string>
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</property>
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<property name="text">
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<string notr="true">{name}</string>
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</property>
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</widget>
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</item>
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<item row="3" column="0">
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<widget class="QRadioButton" name="input_multi_state">
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<property name="text">
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<string notr="true">o&ne file per object-state</string>
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</property>
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</widget>
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</item>
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<item row="3" column="1">
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<widget class="QLineEdit" name="input_multi_state_fmt">
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<property name="enabled">
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<bool>false</bool>
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</property>
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<property name="text">
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<string notr="true">{name}_{state}</string>
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</property>
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</widget>
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</item>
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<item row="5" column="0">
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<spacer name="verticalSpacer_3">
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<property name="orientation">
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<enum>Qt::Vertical</enum>
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</property>
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<property name="sizeHint" stdset="0">
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<size>
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<width>20</width>
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<height>10</height>
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</size>
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</property>
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</spacer>
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</item>
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<item row="4" column="0">
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<widget class="QCheckBox" name="input_multi_prompt">
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<property name="enabled">
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<bool>false</bool>
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</property>
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<property name="text">
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<string notr="true">Prompt for every file</string>
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</property>
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<property name="checked">
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<bool>true</bool>
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</property>
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</widget>
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</item>
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</layout>
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</widget>
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</widget>
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</item>
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<item>
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<widget class="QPushButton" name="button_ok">
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<property name="text">
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<string notr="true">Save...</string>
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</property>
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</widget>
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</item>
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</layout>
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</widget>
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<resources/>
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<connections>
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<connection>
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<sender>input_multi_off</sender>
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<signal>toggled(bool)</signal>
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<receiver>input_multi_prompt</receiver>
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<slot>setDisabled(bool)</slot>
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<hints>
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<hint type="sourcelabel">
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<x>93</x>
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<y>155</y>
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</hint>
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<hint type="destinationlabel">
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<x>190</x>
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<y>272</y>
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</hint>
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</hints>
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</connection>
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<connection>
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<sender>input_multi_object</sender>
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<signal>toggled(bool)</signal>
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<receiver>input_multi_object_fmt</receiver>
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<slot>setEnabled(bool)</slot>
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<hints>
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<hint type="sourcelabel">
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<x>117</x>
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<y>185</y>
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</hint>
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<hint type="destinationlabel">
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<x>224</x>
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<y>189</y>
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</hint>
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</hints>
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</connection>
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<connection>
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<sender>input_multi_state</sender>
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<signal>toggled(bool)</signal>
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<receiver>input_multi_state_fmt</receiver>
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<slot>setEnabled(bool)</slot>
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<hints>
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<hint type="sourcelabel">
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<x>146</x>
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<y>224</y>
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</hint>
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<hint type="destinationlabel">
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<x>217</x>
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<y>225</y>
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</hint>
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</hints>
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</connection>
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</connections>
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</ui>
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