ICODE-ADC/lammps
4
0
Fork 0
Code Issues Pull Requests Actions Packages Projects Releases Wiki Activity

make vdwfactor consistent and speed up rendering for VDW mode by skipping bonds

Browse Source
This commit is contained in:
Axel Kohlmeyer
2023-08-20 00:09:41 -04:00
parent b592542a5b
commit 93f011ad7c
2 changed files with 9 additions and 5 deletions
Download Patch File Download Diff File Expand all files Collapse all files

12
tools/lammps-gui/imageviewer.cpp
View File

@ -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<QPushButton *>(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);
}