" * Pressure control: Not supported.\n",
" * Implicit solvent: Supported.\n",
"A detailed description can be found on the website:\n",
- "http://www.gromacs.org/index.php?title=Download_%26_Installation/Related_Software/OpenMM[PAR]",
+ "http://www.gromacs.org/gpu[PAR]",
/* From the original mdrun documentaion */
"The mdrun program reads the run input file ([TT]-s[tt])",
"and distributes the topology over nodes if needed.",
"pressure, etc, a lot of these things are also printed in the log file.",
"Optionally coordinates can be written to a compressed trajectory file",
"([TT]-x[tt]).[PAR]",
-/* //////////////////////////////////// */
+/* openmm specific information */
"Usage with OpenMM:[BR]",
"$ mdrun -device \"OpenMM:platform=Cuda,memtest=15,deviceid=0,force-device=no\"[PAR]",
"Options:[PAR]",
t_pargs pa[] = {
-/* arguments relevant to OPENMM only */
{ "-pd", FALSE, etBOOL,{&bPartDec},
"Use particle decompostion" },
{ "-dd", FALSE, etRVEC,{&realddxyz},