first minimal stab at LAMMPS GUI
This commit is contained in:
Axel Kohlmeyer
@ -192,6 +192,7 @@ option(BUILD_SHARED_LIBS "Build shared library" OFF)
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option(CMAKE_POSITION_INDEPENDENT_CODE "Create object compatible with shared libraries" ON)
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option(CMAKE_POSITION_INDEPENDENT_CODE "Create object compatible with shared libraries" ON)
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option(BUILD_TOOLS "Build and install LAMMPS tools (msi2lmp, binary2txt, chain)" OFF)
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option(BUILD_TOOLS "Build and install LAMMPS tools (msi2lmp, binary2txt, chain)" OFF)
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option(BUILD_LAMMPS_SHELL "Build and install the LAMMPS shell" OFF)
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option(BUILD_LAMMPS_SHELL "Build and install the LAMMPS shell" OFF)
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option(BUILD_LAMMPS_GUI "Build and install the LAMMPS GUI" OFF)
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# Support using clang-tidy for C++ files with selected options
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# Support using clang-tidy for C++ files with selected options
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set(ENABLE_CLANG_TIDY OFF CACHE BOOL "Include clang-tidy processing when compiling")
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set(ENABLE_CLANG_TIDY OFF CACHE BOOL "Include clang-tidy processing when compiling")
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@ -67,4 +67,8 @@ if(BUILD_LAMMPS_SHELL)
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install(FILES ${LAMMPS_TOOLS_DIR}/lammps-shell/lammps-shell.desktop DESTINATION ${CMAKE_INSTALL_DATAROOTDIR}/applications/)
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install(FILES ${LAMMPS_TOOLS_DIR}/lammps-shell/lammps-shell.desktop DESTINATION ${CMAKE_INSTALL_DATAROOTDIR}/applications/)
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endif()
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endif()
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if(BUILD_LAMMPS_GUI)
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get_filename_component(LAMMPS_GUI_DIR ${LAMMPS_SOURCE_DIR}/../tools/lammps-gui ABSOLUTE)
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get_filename_component(LAMMPS_GUI_BIN ${CMAKE_BINARY_DIR}/lammps-gui-build ABSOLUTE)
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add_subdirectory(${LAMMPS_GUI_DIR} ${LAMMPS_GUI_BIN})
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endif()
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73
tools/lammps-gui/.gitignore
vendored
Normal file
73
tools/lammps-gui/.gitignore
vendored
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@ -0,0 +1,73 @@
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# This file is used to ignore files which are generated
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# ----------------------------------------------------------------------------
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*~
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*.autosave
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*.a
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*.core
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*.moc
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*.o
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*.obj
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*.orig
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*.rej
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*.so
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*.so.*
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*_pch.h.cpp
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*_resource.rc
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*.qm
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.#*
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*.*#
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core
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!core/
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tags
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.DS_Store
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.directory
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*.debug
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Makefile*
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*.prl
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*.app
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moc_*.cpp
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ui_*.h
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qrc_*.cpp
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Thumbs.db
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*.res
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*.rc
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/.qmake.cache
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/.qmake.stash
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# qtcreator generated files
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*.pro.user*
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# xemacs temporary files
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*.flc
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# Vim temporary files
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.*.swp
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# Visual Studio generated files
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*.ib_pdb_index
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*.idb
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*.ilk
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*.pdb
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*.sln
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*.suo
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*.vcproj
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*vcproj.*.*.user
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*.ncb
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*.sdf
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*.opensdf
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*.vcxproj
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*vcxproj.*
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# MinGW generated files
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*.Debug
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*.Release
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# Python byte code
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*.pyc
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# Binaries
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# --------
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*.dll
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*.exe
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98
tools/lammps-gui/CMakeLists.txt
Normal file
98
tools/lammps-gui/CMakeLists.txt
Normal file
@ -0,0 +1,98 @@
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cmake_minimum_required(VERSION 3.10)
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project(lammps-gui VERSION 0.1 LANGUAGES CXX)
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set(CMAKE_INCLUDE_CURRENT_DIR ON)
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set(CMAKE_AUTOUIC ON)
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set(CMAKE_AUTOMOC ON)
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set(CMAKE_AUTORCC ON)
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set(CMAKE_CXX_STANDARD 11)
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set(CMAKE_CXX_STANDARD_REQUIRED ON)
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# when this file is included as subdirectory in the LAMMPS build, many settings are directly imported
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if(LAMMPS_DIR)
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set(LAMMPS_HEADER_DIR ${LAMMPS_SOURCE_DIR})
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set(LAMMPS_LIBRARY lammps)
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else()
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# NOTE: the next line should be commented out when used outside of the LAMMPS package
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get_filename_component(LAMMPS_SOURCE_DIR ${PROJECT_SOURCE_DIR}/../../src ABSOLUTE)
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set(LAMMPS_HEADER_DIR ${LAMMPS_SOURCE_DIR} CACHE PATH "Location of LAMMPS headers")
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if(NOT LAMMPS_HEADER_DIR)
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message(FATAL_ERROR "Must set LAMMPS_HEADER_DIR")
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endif()
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# find LAMMPS library
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find_library(LAMMPS_LIBRARY
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NAMES lammps lammps_serial
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HINTS ${LAMMPS_HEADER_DIR}/../build ${LAMMPS_HEADER_DIR}/../build-clang ${LAMMPS_HEADER_DIR}/../build-test ${LAMMPS_HEADER_DIR}
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REQUIRED
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)
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# by default, install into $HOME/.local (not /usr/local),
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# so that no root access (and sudo) is needed
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if(CMAKE_INSTALL_PREFIX_INITIALIZED_TO_DEFAULT)
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set(CMAKE_INSTALL_PREFIX "$ENV{HOME}/.local" CACHE PATH "Default install path" FORCE)
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endif()
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# ugly hacks for MSVC which by default always reports an old C++ standard in the __cplusplus macro
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# and prints lots of pointless warnings about "unsafe" functions
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if(MSVC)
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if(CMAKE_CXX_COMPILER_ID STREQUAL "MSVC")
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add_compile_options(/Zc:__cplusplus)
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add_compile_options(/wd4244)
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add_compile_options(/wd4267)
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if(LAMMPS_EXCEPTIONS)
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add_compile_options(/EHsc)
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endif()
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endif()
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add_compile_definitions(_CRT_SECURE_NO_WARNINGS)
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endif()
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endif()
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find_package(QT NAMES Qt5 REQUIRED COMPONENTS Widgets)
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find_package(Qt${QT_VERSION_MAJOR} REQUIRED COMPONENTS Widgets)
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set(PROJECT_SOURCES
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main.cpp
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lammpsgui.cpp
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lammpsgui.h
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lammpsgui.ui
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)
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if(${QT_VERSION_MAJOR} GREATER_EQUAL 6)
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qt_add_executable(lammps-gui
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MANUAL_FINALIZATION
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${PROJECT_SOURCES}
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)
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# Define target properties for Android with Qt 6 as:
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# set_property(TARGET lammps-gui APPEND PROPERTY QT_ANDROID_PACKAGE_SOURCE_DIR
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# ${CMAKE_CURRENT_SOURCE_DIR}/android)
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# For more information, see https://doc.qt.io/qt-6/qt-add-executable.html#target-creation
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else()
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if(ANDROID)
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add_library(lammps-gui SHARED
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${PROJECT_SOURCES}
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)
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# Define properties for Android with Qt 5 after find_package() calls as:
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# set(ANDROID_PACKAGE_SOURCE_DIR "${CMAKE_CURRENT_SOURCE_DIR}/android")
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else()
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add_executable(lammps-gui
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${PROJECT_SOURCES}
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)
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endif()
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endif()
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target_include_directories(lammps-gui PRIVATE ${LAMMPS_HEADER_DIR})
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target_link_libraries(lammps-gui PRIVATE Qt${QT_VERSION_MAJOR}::Widgets)
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target_link_libraries(lammps-gui PRIVATE ${LAMMPS_LIBRARY})
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set_target_properties(lammps-gui PROPERTIES
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MACOSX_BUNDLE_GUI_IDENTIFIER my.example.com
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MACOSX_BUNDLE_BUNDLE_VERSION ${PROJECT_VERSION}
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MACOSX_BUNDLE_SHORT_VERSION_STRING ${PROJECT_VERSION_MAJOR}.${PROJECT_VERSION_MINOR}
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MACOSX_BUNDLE TRUE
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WIN32_EXECUTABLE TRUE
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)
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if(QT_VERSION_MAJOR EQUAL 6)
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qt_finalize_executable(lammps-gui)
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endif()
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322
tools/lammps-gui/CMakeLists.txt.user
Normal file
322
tools/lammps-gui/CMakeLists.txt.user
Normal file
@ -0,0 +1,322 @@
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<?xml version="1.0" encoding="UTF-8"?>
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<!DOCTYPE QtCreatorProject>
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<!-- Written by QtCreator 7.0.2, 2023-07-24T17:46:27. -->
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<qtcreator>
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<variable>EnvironmentId</variable>
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<value type="QByteArray">{ed0d4570-2589-4771-8b12-00999b3e43be}</value>
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<variable>ProjectExplorer.Project.ActiveTarget</variable>
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<value type="int" key="EditorConfiguration.IndentSize">4</value>
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<value type="bool" key="EditorConfiguration.KeyboardTooltips">false</value>
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||||||
|
</valuemap>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildConfiguration.BuildStepList.1">
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildStepList.Step.0">
|
||||||
|
<valuelist type="QVariantList" key="CMakeProjectManager.MakeStep.BuildTargets">
|
||||||
|
<value type="QString">clean</value>
|
||||||
|
</valuelist>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildStep.Enabled">true</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Build</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.MakeStep</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildStepList.StepsCount">1</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DefaultDisplayName">Clean</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Clean</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.BuildSteps.Clean</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildConfiguration.BuildStepListCount">2</value>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildConfiguration.ClearSystemEnvironment">false</value>
|
||||||
|
<valuelist type="QVariantList" key="ProjectExplorer.BuildConfiguration.CustomParsers"/>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildConfiguration.ParseStandardOutput">false</value>
|
||||||
|
<valuelist type="QVariantList" key="ProjectExplorer.BuildConfiguration.UserEnvironmentChanges"/>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Debug</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.CMakeBuildConfiguration</value>
|
||||||
|
</valuemap>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.Target.BuildConfiguration.1">
|
||||||
|
<value type="QString" key="CMake.Build.Type">Release</value>
|
||||||
|
<value type="QString" key="CMake.Initial.Parameters">-DCMAKE_GENERATOR:STRING=Ninja
|
||||||
|
-DCMAKE_BUILD_TYPE:STRING=Release
|
||||||
|
-DCMAKE_PROJECT_INCLUDE_BEFORE:FILEPATH=%{IDE:ResourcePath}/package-manager/auto-setup.cmake
|
||||||
|
-DQT_QMAKE_EXECUTABLE:FILEPATH=%{Qt:qmakeExecutable}
|
||||||
|
-DCMAKE_PREFIX_PATH:PATH=%{Qt:QT_INSTALL_PREFIX}
|
||||||
|
-DCMAKE_C_COMPILER:FILEPATH=%{Compiler:Executable:C}
|
||||||
|
-DCMAKE_CXX_COMPILER:FILEPATH=%{Compiler:Executable:Cxx}</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.BuildConfiguration.BuildDirectory">/home/akohlmey/compile/lammps/tools/build-lammps-gui-Desktop-Release</value>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildConfiguration.BuildStepList.0">
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildStepList.Step.0">
|
||||||
|
<valuelist type="QVariantList" key="CMakeProjectManager.MakeStep.BuildTargets">
|
||||||
|
<value type="QString">all</value>
|
||||||
|
</valuelist>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildStep.Enabled">true</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.MakeStep</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildStepList.StepsCount">1</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DefaultDisplayName">Build</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Build</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.BuildSteps.Build</value>
|
||||||
|
</valuemap>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildConfiguration.BuildStepList.1">
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildStepList.Step.0">
|
||||||
|
<valuelist type="QVariantList" key="CMakeProjectManager.MakeStep.BuildTargets">
|
||||||
|
<value type="QString">clean</value>
|
||||||
|
</valuelist>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildStep.Enabled">true</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.MakeStep</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildStepList.StepsCount">1</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DefaultDisplayName">Clean</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Clean</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.BuildSteps.Clean</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildConfiguration.BuildStepListCount">2</value>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildConfiguration.ClearSystemEnvironment">false</value>
|
||||||
|
<valuelist type="QVariantList" key="ProjectExplorer.BuildConfiguration.CustomParsers"/>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildConfiguration.ParseStandardOutput">false</value>
|
||||||
|
<valuelist type="QVariantList" key="ProjectExplorer.BuildConfiguration.UserEnvironmentChanges"/>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Release</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.CMakeBuildConfiguration</value>
|
||||||
|
</valuemap>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.Target.BuildConfiguration.2">
|
||||||
|
<value type="QString" key="CMake.Build.Type">RelWithDebInfo</value>
|
||||||
|
<value type="QString" key="CMake.Initial.Parameters">-DCMAKE_GENERATOR:STRING=Ninja
|
||||||
|
-DCMAKE_BUILD_TYPE:STRING=RelWithDebInfo
|
||||||
|
-DCMAKE_PROJECT_INCLUDE_BEFORE:FILEPATH=%{IDE:ResourcePath}/package-manager/auto-setup.cmake
|
||||||
|
-DQT_QMAKE_EXECUTABLE:FILEPATH=%{Qt:qmakeExecutable}
|
||||||
|
-DCMAKE_PREFIX_PATH:PATH=%{Qt:QT_INSTALL_PREFIX}
|
||||||
|
-DCMAKE_C_COMPILER:FILEPATH=%{Compiler:Executable:C}
|
||||||
|
-DCMAKE_CXX_COMPILER:FILEPATH=%{Compiler:Executable:Cxx}</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.BuildConfiguration.BuildDirectory">/home/akohlmey/compile/lammps/tools/build-lammps-gui-Desktop-RelWithDebInfo</value>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildConfiguration.BuildStepList.0">
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildStepList.Step.0">
|
||||||
|
<valuelist type="QVariantList" key="CMakeProjectManager.MakeStep.BuildTargets">
|
||||||
|
<value type="QString">all</value>
|
||||||
|
</valuelist>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildStep.Enabled">true</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.MakeStep</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildStepList.StepsCount">1</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DefaultDisplayName">Build</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Build</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.BuildSteps.Build</value>
|
||||||
|
</valuemap>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildConfiguration.BuildStepList.1">
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildStepList.Step.0">
|
||||||
|
<valuelist type="QVariantList" key="CMakeProjectManager.MakeStep.BuildTargets">
|
||||||
|
<value type="QString">clean</value>
|
||||||
|
</valuelist>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildStep.Enabled">true</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.MakeStep</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildStepList.StepsCount">1</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DefaultDisplayName">Clean</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Clean</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.BuildSteps.Clean</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildConfiguration.BuildStepListCount">2</value>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildConfiguration.ClearSystemEnvironment">false</value>
|
||||||
|
<valuelist type="QVariantList" key="ProjectExplorer.BuildConfiguration.CustomParsers"/>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildConfiguration.ParseStandardOutput">false</value>
|
||||||
|
<valuelist type="QVariantList" key="ProjectExplorer.BuildConfiguration.UserEnvironmentChanges"/>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Release with Debug Information</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.CMakeBuildConfiguration</value>
|
||||||
|
</valuemap>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.Target.BuildConfiguration.3">
|
||||||
|
<value type="QString" key="CMake.Build.Type">MinSizeRel</value>
|
||||||
|
<value type="QString" key="CMake.Initial.Parameters">-DCMAKE_GENERATOR:STRING=Ninja
|
||||||
|
-DCMAKE_BUILD_TYPE:STRING=MinSizeRel
|
||||||
|
-DCMAKE_PROJECT_INCLUDE_BEFORE:FILEPATH=%{IDE:ResourcePath}/package-manager/auto-setup.cmake
|
||||||
|
-DQT_QMAKE_EXECUTABLE:FILEPATH=%{Qt:qmakeExecutable}
|
||||||
|
-DCMAKE_PREFIX_PATH:PATH=%{Qt:QT_INSTALL_PREFIX}
|
||||||
|
-DCMAKE_C_COMPILER:FILEPATH=%{Compiler:Executable:C}
|
||||||
|
-DCMAKE_CXX_COMPILER:FILEPATH=%{Compiler:Executable:Cxx}</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.BuildConfiguration.BuildDirectory">/home/akohlmey/compile/lammps/tools/build-lammps-gui-Desktop-MinSizeRel</value>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildConfiguration.BuildStepList.0">
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildStepList.Step.0">
|
||||||
|
<valuelist type="QVariantList" key="CMakeProjectManager.MakeStep.BuildTargets">
|
||||||
|
<value type="QString">all</value>
|
||||||
|
</valuelist>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildStep.Enabled">true</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.MakeStep</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildStepList.StepsCount">1</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DefaultDisplayName">Build</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Build</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.BuildSteps.Build</value>
|
||||||
|
</valuemap>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildConfiguration.BuildStepList.1">
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildStepList.Step.0">
|
||||||
|
<valuelist type="QVariantList" key="CMakeProjectManager.MakeStep.BuildTargets">
|
||||||
|
<value type="QString">clean</value>
|
||||||
|
</valuelist>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildStep.Enabled">true</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.MakeStep</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildStepList.StepsCount">1</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DefaultDisplayName">Clean</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Clean</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.BuildSteps.Clean</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildConfiguration.BuildStepListCount">2</value>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildConfiguration.ClearSystemEnvironment">false</value>
|
||||||
|
<valuelist type="QVariantList" key="ProjectExplorer.BuildConfiguration.CustomParsers"/>
|
||||||
|
<value type="bool" key="ProjectExplorer.BuildConfiguration.ParseStandardOutput">false</value>
|
||||||
|
<valuelist type="QVariantList" key="ProjectExplorer.BuildConfiguration.UserEnvironmentChanges"/>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Minimum Size Release</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.CMakeBuildConfiguration</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.Target.BuildConfigurationCount">4</value>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.Target.DeployConfiguration.0">
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.BuildConfiguration.BuildStepList.0">
|
||||||
|
<value type="int" key="ProjectExplorer.BuildStepList.StepsCount">0</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DefaultDisplayName">Deploy</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">Deploy</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.BuildSteps.Deploy</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.BuildConfiguration.BuildStepListCount">1</value>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.DeployConfiguration.CustomData"/>
|
||||||
|
<value type="bool" key="ProjectExplorer.DeployConfiguration.CustomDataEnabled">false</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">ProjectExplorer.DefaultDeployConfiguration</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.Target.DeployConfigurationCount">1</value>
|
||||||
|
<valuemap type="QVariantMap" key="ProjectExplorer.Target.RunConfiguration.0">
|
||||||
|
<value type="bool" key="Analyzer.Perf.Settings.UseGlobalSettings">true</value>
|
||||||
|
<value type="bool" key="Analyzer.QmlProfiler.Settings.UseGlobalSettings">true</value>
|
||||||
|
<value type="bool" key="Analyzer.Valgrind.Settings.UseGlobalSettings">true</value>
|
||||||
|
<valuelist type="QVariantList" key="CustomOutputParsers"/>
|
||||||
|
<value type="int" key="PE.EnvironmentAspect.Base">2</value>
|
||||||
|
<valuelist type="QVariantList" key="PE.EnvironmentAspect.Changes"/>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.DisplayName">lammps-gui</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.ProjectConfiguration.Id">CMakeProjectManager.CMakeRunConfiguration.lammps-gui</value>
|
||||||
|
<value type="QString" key="ProjectExplorer.RunConfiguration.BuildKey">lammps-gui</value>
|
||||||
|
<value type="bool" key="RunConfiguration.UseCppDebugger">false</value>
|
||||||
|
<value type="bool" key="RunConfiguration.UseCppDebuggerAuto">true</value>
|
||||||
|
<value type="bool" key="RunConfiguration.UseLibrarySearchPath">true</value>
|
||||||
|
<value type="bool" key="RunConfiguration.UseQmlDebugger">false</value>
|
||||||
|
<value type="bool" key="RunConfiguration.UseQmlDebuggerAuto">true</value>
|
||||||
|
<value type="QString" key="RunConfiguration.WorkingDirectory.default">/home/akohlmey/compile/lammps/tools/build-lammps-gui-Desktop-Debug</value>
|
||||||
|
</valuemap>
|
||||||
|
<value type="int" key="ProjectExplorer.Target.RunConfigurationCount">1</value>
|
||||||
|
</valuemap>
|
||||||
|
</data>
|
||||||
|
<data>
|
||||||
|
<variable>ProjectExplorer.Project.TargetCount</variable>
|
||||||
|
<value type="int">1</value>
|
||||||
|
</data>
|
||||||
|
<data>
|
||||||
|
<variable>ProjectExplorer.Project.Updater.FileVersion</variable>
|
||||||
|
<value type="int">22</value>
|
||||||
|
</data>
|
||||||
|
<data>
|
||||||
|
<variable>Version</variable>
|
||||||
|
<value type="int">22</value>
|
||||||
|
</data>
|
||||||
|
</qtcreator>
|
||||||
183
tools/lammps-gui/lammpsgui.cpp
Normal file
183
tools/lammps-gui/lammpsgui.cpp
Normal file
@ -0,0 +1,183 @@
|
|||||||
|
#include "lammpsgui.h"
|
||||||
|
#include "./ui_lammpsgui.h"
|
||||||
|
#include "library.h"
|
||||||
|
|
||||||
|
#include <string>
|
||||||
|
#include <QFile>
|
||||||
|
#include <QFileDialog>
|
||||||
|
#include <QFont>
|
||||||
|
#include <QTextStream>
|
||||||
|
#include <QMessageBox>
|
||||||
|
|
||||||
|
LammpsGui::LammpsGui(QWidget *parent)
|
||||||
|
: QMainWindow(parent), ui(new Ui::LammpsGui), lammps_handle(nullptr)
|
||||||
|
{
|
||||||
|
ui->setupUi(this);
|
||||||
|
this->setCentralWidget(ui->textEdit);
|
||||||
|
current_file.clear();
|
||||||
|
current_line = 0;
|
||||||
|
text_font.setFamily("monospace");
|
||||||
|
text_font.setFixedPitch(true);
|
||||||
|
text_font.setStyleHint(QFont::TypeWriter);
|
||||||
|
ui->textEdit->setCurrentFont(text_font);
|
||||||
|
|
||||||
|
connect(ui->actionNew, &QAction::triggered, this, &LammpsGui::new_document);
|
||||||
|
connect(ui->actionOpen, &QAction::triggered, this, &LammpsGui::open);
|
||||||
|
connect(ui->actionSave, &QAction::triggered, this, &LammpsGui::save);
|
||||||
|
connect(ui->actionSave_As, &QAction::triggered, this, &LammpsGui::save_as);
|
||||||
|
connect(ui->actionQuit, &QAction::triggered, this, &LammpsGui::quit);
|
||||||
|
connect(ui->actionCopy, &QAction::triggered, this, &LammpsGui::copy);
|
||||||
|
connect(ui->actionCut, &QAction::triggered, this, &LammpsGui::cut);
|
||||||
|
connect(ui->actionPaste, &QAction::triggered, this, &LammpsGui::paste);
|
||||||
|
connect(ui->actionUndo, &QAction::triggered, this, &LammpsGui::undo);
|
||||||
|
connect(ui->actionRedo, &QAction::triggered, this, &LammpsGui::redo);
|
||||||
|
connect(ui->actionClear, &QAction::triggered, this, &LammpsGui::clear);
|
||||||
|
connect(ui->actionRun_Buffer, &QAction::triggered, this, &LammpsGui::run_buffer);
|
||||||
|
connect(ui->actionExecute_Line, &QAction::triggered, this, &LammpsGui::run_line);
|
||||||
|
// connect(ui->actionAbout, &QAction::triggered, this, &LammpsGui::about);
|
||||||
|
|
||||||
|
#if !QT_CONFIG(clipboard)
|
||||||
|
ui->actionCut->setEnabled(false);
|
||||||
|
ui->actionCopy->setEnabled(false);
|
||||||
|
ui->actionPaste->setEnabled(false);
|
||||||
|
#endif
|
||||||
|
}
|
||||||
|
|
||||||
|
LammpsGui::~LammpsGui()
|
||||||
|
{
|
||||||
|
delete ui;
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::new_document()
|
||||||
|
{
|
||||||
|
current_file.clear();
|
||||||
|
current_line = 0;
|
||||||
|
ui->textEdit->setText(QString());
|
||||||
|
if (lammps_handle) lammps_close(lammps_handle);
|
||||||
|
lammps_handle = nullptr;
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::open()
|
||||||
|
{
|
||||||
|
QString fileName = QFileDialog::getOpenFileName(this, "Open the file");
|
||||||
|
QFile file(fileName);
|
||||||
|
current_file = fileName;
|
||||||
|
current_line = 0;
|
||||||
|
if (!file.open(QIODevice::ReadOnly | QFile::Text)) {
|
||||||
|
QMessageBox::warning(this, "Warning", "Cannot open file: " + file.errorString());
|
||||||
|
return;
|
||||||
|
}
|
||||||
|
setWindowTitle(fileName);
|
||||||
|
QTextStream in(&file);
|
||||||
|
QString text = in.readAll();
|
||||||
|
ui->textEdit->setText(text);
|
||||||
|
file.close();
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::save()
|
||||||
|
{
|
||||||
|
QString fileName;
|
||||||
|
// If we don't have a filename from before, get one.
|
||||||
|
if (current_file.isEmpty()) {
|
||||||
|
fileName = QFileDialog::getSaveFileName(this, "Save");
|
||||||
|
current_file = fileName;
|
||||||
|
} else {
|
||||||
|
fileName = current_file;
|
||||||
|
}
|
||||||
|
QFile file(fileName);
|
||||||
|
if (!file.open(QIODevice::WriteOnly | QFile::Text)) {
|
||||||
|
QMessageBox::warning(this, "Warning", "Cannot save file: " + file.errorString());
|
||||||
|
return;
|
||||||
|
}
|
||||||
|
setWindowTitle(fileName);
|
||||||
|
QTextStream out(&file);
|
||||||
|
QString text = ui->textEdit->toPlainText();
|
||||||
|
out << text;
|
||||||
|
file.close();
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::save_as()
|
||||||
|
{
|
||||||
|
QString fileName = QFileDialog::getSaveFileName(this, "Save as");
|
||||||
|
QFile file(fileName);
|
||||||
|
|
||||||
|
if (!file.open(QFile::WriteOnly | QFile::Text)) {
|
||||||
|
QMessageBox::warning(this, "Warning", "Cannot save file: " + file.errorString());
|
||||||
|
return;
|
||||||
|
}
|
||||||
|
current_file = fileName;
|
||||||
|
setWindowTitle(fileName);
|
||||||
|
QTextStream out(&file);
|
||||||
|
QString text = ui->textEdit->toPlainText();
|
||||||
|
out << text;
|
||||||
|
file.close();
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::quit()
|
||||||
|
{
|
||||||
|
if (lammps_handle) {
|
||||||
|
lammps_close(lammps_handle);
|
||||||
|
lammps_mpi_finalize();
|
||||||
|
lammps_kokkos_finalize();
|
||||||
|
lammps_python_finalize();
|
||||||
|
}
|
||||||
|
QCoreApplication::quit();
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::copy()
|
||||||
|
{
|
||||||
|
#if QT_CONFIG(clipboard)
|
||||||
|
ui->textEdit->copy();
|
||||||
|
#endif
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::cut()
|
||||||
|
{
|
||||||
|
#if QT_CONFIG(clipboard)
|
||||||
|
ui->textEdit->cut();
|
||||||
|
#endif
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::paste()
|
||||||
|
{
|
||||||
|
#if QT_CONFIG(clipboard)
|
||||||
|
ui->textEdit->paste();
|
||||||
|
#endif
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::undo()
|
||||||
|
{
|
||||||
|
ui->textEdit->undo();
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::redo()
|
||||||
|
{
|
||||||
|
ui->textEdit->redo();
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::run_buffer()
|
||||||
|
{
|
||||||
|
clear();
|
||||||
|
if (!lammps_handle) lammps_handle = lammps_open_no_mpi(0, nullptr, nullptr);
|
||||||
|
if (!lammps_handle) return;
|
||||||
|
std::string buffer = ui->textEdit->toPlainText().toStdString();
|
||||||
|
lammps_commands_string(lammps_handle, buffer.c_str());
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::run_line()
|
||||||
|
{
|
||||||
|
// dummy
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::clear()
|
||||||
|
{
|
||||||
|
if (lammps_handle) {
|
||||||
|
lammps_command(lammps_handle, "clear");
|
||||||
|
current_line = 0;
|
||||||
|
}
|
||||||
|
}
|
||||||
|
|
||||||
|
void LammpsGui::about()
|
||||||
|
{
|
||||||
|
// dummy
|
||||||
|
}
|
||||||
43
tools/lammps-gui/lammpsgui.h
Normal file
43
tools/lammps-gui/lammpsgui.h
Normal file
@ -0,0 +1,43 @@
|
|||||||
|
#ifndef LAMMPSGUI_H
|
||||||
|
#define LAMMPSGUI_H
|
||||||
|
|
||||||
|
#include <QMainWindow>
|
||||||
|
#include <QFont>
|
||||||
|
#include <QString>
|
||||||
|
|
||||||
|
QT_BEGIN_NAMESPACE
|
||||||
|
namespace Ui { class LammpsGui; }
|
||||||
|
QT_END_NAMESPACE
|
||||||
|
|
||||||
|
class LammpsGui : public QMainWindow
|
||||||
|
{
|
||||||
|
Q_OBJECT
|
||||||
|
|
||||||
|
public:
|
||||||
|
LammpsGui(QWidget *parent = nullptr);
|
||||||
|
~LammpsGui();
|
||||||
|
|
||||||
|
private slots:
|
||||||
|
void new_document();
|
||||||
|
void open();
|
||||||
|
void save();
|
||||||
|
void save_as();
|
||||||
|
void quit();
|
||||||
|
void copy();
|
||||||
|
void cut();
|
||||||
|
void paste();
|
||||||
|
void undo();
|
||||||
|
void redo();
|
||||||
|
void clear();
|
||||||
|
void run_buffer();
|
||||||
|
void run_line();
|
||||||
|
void about();
|
||||||
|
|
||||||
|
private:
|
||||||
|
Ui::LammpsGui *ui;
|
||||||
|
QString current_file;
|
||||||
|
QFont text_font;
|
||||||
|
int current_line;
|
||||||
|
void *lammps_handle;
|
||||||
|
};
|
||||||
|
#endif // LAMMPSGUI_H
|
||||||
152
tools/lammps-gui/lammpsgui.ui
Normal file
152
tools/lammps-gui/lammpsgui.ui
Normal file
@ -0,0 +1,152 @@
|
|||||||
|
<?xml version="1.0" encoding="UTF-8"?>
|
||||||
|
<ui version="4.0">
|
||||||
|
<class>LammpsGui</class>
|
||||||
|
<widget class="QMainWindow" name="LammpsGui">
|
||||||
|
<property name="geometry">
|
||||||
|
<rect>
|
||||||
|
<x>0</x>
|
||||||
|
<y>0</y>
|
||||||
|
<width>800</width>
|
||||||
|
<height>600</height>
|
||||||
|
</rect>
|
||||||
|
</property>
|
||||||
|
<property name="windowTitle">
|
||||||
|
<string>LammpsGui</string>
|
||||||
|
</property>
|
||||||
|
<widget class="QWidget" name="centralwidget">
|
||||||
|
<widget class="QWidget" name="verticalLayoutWidget">
|
||||||
|
<property name="geometry">
|
||||||
|
<rect>
|
||||||
|
<x>0</x>
|
||||||
|
<y>40</y>
|
||||||
|
<width>741</width>
|
||||||
|
<height>381</height>
|
||||||
|
</rect>
|
||||||
|
</property>
|
||||||
|
<layout class="QVBoxLayout" name="verticalLayout">
|
||||||
|
<item>
|
||||||
|
<widget class="QTextEdit" name="textEdit"/>
|
||||||
|
</item>
|
||||||
|
</layout>
|
||||||
|
</widget>
|
||||||
|
</widget>
|
||||||
|
<widget class="QMenuBar" name="menubar">
|
||||||
|
<property name="geometry">
|
||||||
|
<rect>
|
||||||
|
<x>0</x>
|
||||||
|
<y>0</y>
|
||||||
|
<width>800</width>
|
||||||
|
<height>23</height>
|
||||||
|
</rect>
|
||||||
|
</property>
|
||||||
|
<widget class="QMenu" name="menuFile">
|
||||||
|
<property name="title">
|
||||||
|
<string>File</string>
|
||||||
|
</property>
|
||||||
|
<addaction name="actionNew"/>
|
||||||
|
<addaction name="actionOpen"/>
|
||||||
|
<addaction name="separator"/>
|
||||||
|
<addaction name="actionSave"/>
|
||||||
|
<addaction name="actionSave_As"/>
|
||||||
|
<addaction name="separator"/>
|
||||||
|
<addaction name="actionQuit"/>
|
||||||
|
</widget>
|
||||||
|
<widget class="QMenu" name="menuEdit">
|
||||||
|
<property name="title">
|
||||||
|
<string>Edit</string>
|
||||||
|
</property>
|
||||||
|
<addaction name="actionUndo"/>
|
||||||
|
<addaction name="actionRedo"/>
|
||||||
|
<addaction name="separator"/>
|
||||||
|
<addaction name="actionCopy"/>
|
||||||
|
<addaction name="actionCut"/>
|
||||||
|
<addaction name="actionPaste"/>
|
||||||
|
</widget>
|
||||||
|
<widget class="QMenu" name="menuRun">
|
||||||
|
<property name="title">
|
||||||
|
<string>Run</string>
|
||||||
|
</property>
|
||||||
|
<addaction name="actionClear"/>
|
||||||
|
<addaction name="actionRun_Buffer"/>
|
||||||
|
<addaction name="actionExecute_Line"/>
|
||||||
|
</widget>
|
||||||
|
<widget class="QMenu" name="menuAbout">
|
||||||
|
<property name="title">
|
||||||
|
<string>About</string>
|
||||||
|
</property>
|
||||||
|
</widget>
|
||||||
|
<addaction name="menuFile"/>
|
||||||
|
<addaction name="menuEdit"/>
|
||||||
|
<addaction name="menuRun"/>
|
||||||
|
<addaction name="menuAbout"/>
|
||||||
|
</widget>
|
||||||
|
<widget class="QStatusBar" name="statusbar"/>
|
||||||
|
<action name="actionNew">
|
||||||
|
<property name="text">
|
||||||
|
<string>New</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionOpen">
|
||||||
|
<property name="text">
|
||||||
|
<string>Open</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionSave">
|
||||||
|
<property name="text">
|
||||||
|
<string>Save</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionSave_As">
|
||||||
|
<property name="text">
|
||||||
|
<string>Save As</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionQuit">
|
||||||
|
<property name="text">
|
||||||
|
<string>Quit</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionCut">
|
||||||
|
<property name="text">
|
||||||
|
<string>Cut</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionCopy">
|
||||||
|
<property name="text">
|
||||||
|
<string>Copy</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionPaste">
|
||||||
|
<property name="text">
|
||||||
|
<string>Paste</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionUndo">
|
||||||
|
<property name="text">
|
||||||
|
<string>Undo</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionRedo">
|
||||||
|
<property name="text">
|
||||||
|
<string>Redo</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionClear">
|
||||||
|
<property name="text">
|
||||||
|
<string>Clear</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionRun_Buffer">
|
||||||
|
<property name="text">
|
||||||
|
<string>Execute Buffer</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
<action name="actionExecute_Line">
|
||||||
|
<property name="text">
|
||||||
|
<string>Execute Line</string>
|
||||||
|
</property>
|
||||||
|
</action>
|
||||||
|
</widget>
|
||||||
|
<resources/>
|
||||||
|
<connections/>
|
||||||
|
</ui>
|
||||||
11
tools/lammps-gui/main.cpp
Normal file
11
tools/lammps-gui/main.cpp
Normal file
@ -0,0 +1,11 @@
|
|||||||
|
#include "lammpsgui.h"
|
||||||
|
|
||||||
|
#include <QApplication>
|
||||||
|
|
||||||
|
int main(int argc, char *argv[])
|
||||||
|
{
|
||||||
|
QApplication a(argc, argv);
|
||||||
|
LammpsGui w;
|
||||||
|
w.show();
|
||||||
|
return a.exec();
|
||||||
|
}
|
||||||
Reference in New Issue
Block a user