Adding step number and forcefield fields to gromacs UI

VTX-Molecular-Visualization · May 22, 2024 · a841f22 · a841f22
1 parent dc93ce2
commit a841f22
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Showing 5 changed files with 9 additions and 1 deletion.
diff --git a/lib/tool/tools/mdprep/include/tools/mdprep/gromacs/pack.hpp b/lib/tool/tools/mdprep/include/tools/mdprep/gromacs/pack.hpp
diff --git a/lib/tool/tools/mdprep/include/tools/mdprep/ui/basic_form.hpp b/lib/tool/tools/mdprep/include/tools/mdprep/ui/basic_form.hpp
diff --git a/lib/tool/tools/mdprep/src/mdprep.cpp b/lib/tool/tools/mdprep/src/mdprep.cpp
@@ -46,7 +46,7 @@ namespace VTX::QT::Mdprep
 			QWidget * const mainWidget = _instantiateMainWidget( PREFERRED_SIZE, PREFERRED_SIZE );
 
 			UI::QT::QtDockablePanel::_setupUi( p_name );
-
+			this->setWindowIcon( QIcon( ":/sprite/icon_tool_mdprep_mainButton.png" ) );
 			this->setWindowTitle( "Molecular Dynamics Preparation" );
 
 			setWindowState( Qt::WindowState::WindowActive );
@@ -79,6 +79,12 @@ namespace VTX::QT::Mdprep
 					{ _formBasic.layoutFieldsMdEngine(), _formBasic.layoutFieldsMdEngine() }
 				);
 			_formsMd[ _mdEngineCurrentIdx ]->activate();
+
+			const VTX::Tool::Mdprep::ui::EngineSpecificCommonFormData * engineSpecificData = nullptr;
+			_formsMd[ _mdEngineCurrentIdx ]->get( engineSpecificData );
+			if ( engineSpecificData )
+				_formBasic.update( *engineSpecificData );
+
 			VTX::VTX_DEBUG( "info from Mdprep::MainWindow::_updateFormEngine({})", idx );
 		}
 		virtual void _setupSlots()

diff --git a/lib/tool/tools/mdprep/src/ui/basic_form.cpp b/lib/tool/tools/mdprep/src/ui/basic_form.cpp
diff --git a/lib/tool/tools/mdprep/src/ui/main_window.cpp b/lib/tool/tools/mdprep/src/ui/main_window.cpp
@@ -47,6 +47,8 @@ namespace VTX::Tool::Mdprep::ui
 
 	void MdFieldsOrganizer::setupUi( QLayout * p_layout ) noexcept
 	{
+		// At first IU wanted to put all advanced settings in a collapsible panel but it seems unintuitive to create one
+		// with Qt so I decided to make tabs instead. But it shall be easy to change in the future if we want to.
 		QTabWidget * wTab = new QTabWidget();
 		p_layout->addWidget( wTab );