diff --git a/tools/lammps-gui/CMakeLists.txt b/tools/lammps-gui/CMakeLists.txt index 6202d3a600..67e8807b1e 100644 --- a/tools/lammps-gui/CMakeLists.txt +++ b/tools/lammps-gui/CMakeLists.txt @@ -1,6 +1,6 @@ cmake_minimum_required(VERSION 3.16) -project(lammps-gui VERSION 1.2.3 LANGUAGES CXX) +project(lammps-gui VERSION 1.2.4 LANGUAGES CXX) set(CMAKE_AUTOUIC ON) set(CMAKE_AUTOMOC ON) diff --git a/tools/lammps-gui/imageviewer.cpp b/tools/lammps-gui/imageviewer.cpp index 4f94f7a3fc..4d68af3a8b 100644 --- a/tools/lammps-gui/imageviewer.cpp +++ b/tools/lammps-gui/imageviewer.cpp @@ -78,7 +78,7 @@ ImageViewer::ImageViewer(const QString &fileName, LammpsWrapper *_lammps, QWidge QSettings settings; - vdwfactor = 0.4; + vdwfactor = 0.5; auto pix = QPixmap(":/emblem-photos.png"); auto *renderstatus = new QLabel(QString()); @@ -278,7 +278,7 @@ void ImageViewer::toggle_vdw() { QPushButton *button = qobject_cast(sender()); if (vdwfactor > 1.0) - vdwfactor = 0.4; + vdwfactor = 0.5; else vdwfactor = 1.6; button->setChecked(vdwfactor > 1.0); @@ -391,8 +391,12 @@ void ImageViewer::createImage() dumpcmd += QString(" size ") + QString::number(tmpxsize) + blank + QString::number(tmpysize); dumpcmd += QString(" zoom ") + QString::number(zoom); dumpcmd += " shiny 0.5 "; - if (nbondtypes > 0) dumpcmd += " bond atom 0.4 "; - + if (nbondtypes > 0) { + if (vdwfactor > 1.0) + dumpcmd += " bond none none "; + else + dumpcmd += " bond atom 0.5 "; + } if (lammps->extract_setting("dimension") == 3) { dumpcmd += QString(" view ") + QString::number(hhrot) + blank + QString::number(vrot); }