Public Git Hosting - gromacs.git/search

2010-05-14	Rossen Apostolov	The relative error for calculation of Ewald and PME...	commit \| commitdiff \| tree
2010-05-12	Rossen Apostolov	Merge branch 'master' of git.gromacs.org:gromacs	commit \| commitdiff \| tree
2010-05-12	Rossen Apostolov	Fix for Urey-Bradley potential in OpenMM	commit \| commitdiff \| tree
2010-05-11	Rossen Apostolov	Added support for Urey-Bradley potentials to the openmm...	commit \| commitdiff \| tree
2010-05-04	Rossen Apostolov	Fixed improper error message in openmm_wrapper.	commit \| commitdiff \| tree
2010-04-01	Rossen Apostolov	Minor fixes of typos.	commit \| commitdiff \| tree
2010-03-31	Rossen Apostolov	Fixed a gmx_warning crash in openmm_wrapper.cpp	commit \| commitdiff \| tree
2010-03-31	Rossen Apostolov	Fixed src/contrib/options.c to use the new parse_common_args...	commit \| commitdiff \| tree
2010-03-27	Rossen Apostolov	OpenMM: "md" option is now accepted.	commit \| commitdiff \| tree
2010-03-24	Rossen Apostolov	Allowing also CUDA versions later than 2.3.	commit \| commitdiff \| tree
2010-03-24	Rossen Apostolov	Signal handling is now enabled for the openmm platform.	commit \| commitdiff \| tree
2010-03-17	Rossen Apostolov	openmm: some cleanup in md_openmm.c and mdrun.c	commit \| commitdiff \| tree
2010-03-12	Rossen Apostolov	Enabled checkpoints in OpenMM.	commit \| commitdiff \| tree
2010-03-12	Rossen Apostolov	Automatically disable threads for OpenMM builds.	commit \| commitdiff \| tree
2010-03-11	Rossen Apostolov	Various fixes.	commit \| commitdiff \| tree
2010-03-11	Rossen Apostolov	Small fixes in mdrun desc.; enable periodic molecules	commit \| commitdiff \| tree
2010-03-11	Rossen Apostolov	Enalbed -maxh option for usage with OpenMM binaries	commit \| commitdiff \| tree
2010-03-11	Rossen Apostolov	Cleaned up do_md_openmm.	commit \| commitdiff \| tree
2010-03-11	Rossen Apostolov	Reworked the integrator and thermostat options.	commit \| commitdiff \| tree
2010-03-11	Rossen Apostolov	Fixed the wrong output time frames	commit \| commitdiff \| tree
2010-03-11	Rossen Apostolov	do_md_opennmm.h (aka patched) now works but the time...	commit \| commitdiff \| tree
2010-03-11	Rossen Apostolov	Initial porting, do_md_openmm_nopatch.h is used.	commit \| commitdiff \| tree
2009-10-02	Rossen Apostolov	Users are now refered to the new website in case of...	commit \| commitdiff \| tree
2009-08-17	Rossen Apostolov	Fixed incorrect scaling of forces in reciprocal space...	commit \| commitdiff \| tree

The ultimate molecular dynamics simulation package

RSS Atom