BioD PNPI Git Repos - alexxy/gromacs.git/search

biod.pnpi.spb.ru / alexxy / gromacs.git / search

2015-07-24	Rossen Apostolov	Converted correlationfuntcions to C++.	commit \| commitdiff \| tree
2015-06-15	Rossen Apostolov	Building own fftw now uses version 3.3.4	commit \| commitdiff \| tree
2015-06-02	Rossen Apostolov	Converted random module to C++.	commit \| commitdiff \| tree
2015-05-27	Rossen Apostolov	Converted pulling code to C++.	commit \| commitdiff \| tree
2015-05-12	Rossen Apostolov	Added a note about sc-coul being auto turned on.	commit \| commitdiff \| tree
2014-09-26	Rossen Apostolov	Converted swap module to C++.	commit \| commitdiff \| tree
2014-09-09	Rossen Apostolov	Converted groupcoord to C++.	commit \| commitdiff \| tree
2014-09-09	Rossen Apostolov	Converted fft files to C++.	commit \| commitdiff \| tree
2014-06-29	Rossen Apostolov	Use cosistent style when referring to force fields.	commit \| commitdiff \| tree
2014-06-27	Rossen Apostolov	Changed linking order to make Extrae work.	commit \| commitdiff \| tree
2014-06-27	Rossen Apostolov	Added information about dihedral restraints.	commit \| commitdiff \| tree
2014-06-27	Rossen Apostolov	Remove install_manifest.txt during make clean.	commit \| commitdiff \| tree
2014-06-24	Rossen Apostolov	Extend version checking/warnings for checkpoint continuation	commit \| commitdiff \| tree
2014-06-23	Rossen Apostolov	Added tip5p to the list of watermodels in some FF.	commit \| commitdiff \| tree
2014-06-22	Rossen Apostolov	More clear message for undefined pullgroups.	commit \| commitdiff \| tree
2014-06-20	Rossen Apostolov	Fixed typo in oplsaa ASPH charges.	commit \| commitdiff \| tree
2014-06-20	Rossen Apostolov	Removed unused parameters and cleanup of inputrec.	commit \| commitdiff \| tree
2014-06-19	Rossen Apostolov	Small typos in surface tension description.	commit \| commitdiff \| tree
2014-06-18	Rossen Apostolov	Added reference to cmap in pdb2gmx.	commit \| commitdiff \| tree
2014-06-17	Rossen Apostolov	Small changes in appendix A of the manual.	commit \| commitdiff \| tree
2014-06-14	Rossen Apostolov	Added tip5pe water model to oplsa.	commit \| commitdiff \| tree
2014-06-12	Rossen Apostolov	Cleanup environment variables.	commit \| commitdiff \| tree
2014-06-11	Rossen Apostolov	Mapped HIS1 to HSD in charmm27.	commit \| commitdiff \| tree
2014-06-10	Rossen Apostolov	Print in higher precision repl_ex timestep.	commit \| commitdiff \| tree
2014-06-09	Rossen Apostolov	Issue a warning for using gmx_rms -prev with large...	commit \| commitdiff \| tree
2014-06-09	Rossen Apostolov	Install libraries in correct directories on multiarch...	commit \| commitdiff \| tree
2014-06-09	Rossen Apostolov	Fixed typo in description of conversion factors.	commit \| commitdiff \| tree
2014-06-04	Rossen Apostolov	Updated C-/N-terminal partial charges in Amber03.ff.	commit \| commitdiff \| tree
2014-05-24	Rossen Apostolov	Simplified section "Porting".	commit \| commitdiff \| tree
2014-05-24	Rossen Apostolov	Allow trjconv to keep some box dimensions unchanged.	commit \| commitdiff \| tree
2014-05-22	Rossen Apostolov	Normal modes don't work currently with virtual sites...	commit \| commitdiff \| tree
2014-05-20	Rossen Apostolov	Added a note about using direction-periodic pulling.	commit \| commitdiff \| tree
2014-05-20	Rossen Apostolov	Added a note about unsupported Verlet cutoff + Buckingham.	commit \| commitdiff \| tree
2014-03-31	Rossen Apostolov	Added CMake support for Extrae.	commit \| commitdiff \| tree
2014-03-17	Rossen Apostolov	Cleaned up endif/else-s in CMakeLists.txt and *.cmake...	commit \| commitdiff \| tree
2014-03-11	Rossen Apostolov	Removed .itp files from top level directory.	commit \| commitdiff \| tree
2014-03-06	Rossen Apostolov	Removed the deprecated gmx.ff and gmx2.ff.	commit \| commitdiff \| tree
2014-02-23	Rossen Apostolov	Removed deprecated Encad FF.	commit \| commitdiff \| tree
2014-02-20	Rossen Apostolov	Rename ffopen and ffclose to gmx_ff*.	commit \| commitdiff \| tree
2014-01-30	Rossen Apostolov	Removed ions.itp from GMX/share/top directory.	commit \| commitdiff \| tree
2014-01-28	Rossen Apostolov	Bump own fftw build to version 3.3.3	commit \| commitdiff \| tree
2014-01-21	Rossen Apostolov	Fixed wrong message when building own FFTW.	commit \| commitdiff \| tree
2013-11-28	Rossen Apostolov	Updated to gmock-1.7.0	commit \| commitdiff \| tree
2011-11-25	Rossen Apostolov	Added support for submission to cdash servers.	commit \| commitdiff \| tree
2011-09-27	Rossen Apostolov	Merge "Removed CMake warning for recent OpenMPI versions...	commit \| commitdiff \| tree
2011-09-21	Rossen Apostolov	Updated version: now 4.6	commit \| commitdiff \| tree
2011-09-20	Rossen Apostolov	New release: 4.5.5	commit \| commitdiff \| tree
2011-09-19	Rossen Apostolov	Merge "Resolved gerrit issue https://gerrit.gromacs...	commit \| commitdiff \| tree
2011-09-19	Rossen Apostolov	Added support for g_dos, g_hydorder and g_densorder...	commit \| commitdiff \| tree
2011-09-19	Rossen Apostolov	Fixed a bug in egbOBC and double precission.	commit \| commitdiff \| tree
2011-09-16	Rossen Apostolov	Merge "g_wham: fixed pullx.xvg reading issue with pull_geome...	commit \| commitdiff \| tree
2011-09-13	Rossen Apostolov	Merge "Added warning line." into release-4-5-patches	commit \| commitdiff \| tree
2011-09-13	Rossen Apostolov	Merge "Fixes for CMake finding FORTRAN library names...	commit \| commitdiff \| tree
2011-09-09	Rossen Apostolov	Added support for custom external BLAS/LAPACK libraries.	commit \| commitdiff \| tree
2011-05-18	Rossen Apostolov	Fixed g_tcaf citation in html docs	commit \| commitdiff \| tree
2011-03-21	Rossen Apostolov	New maintenance release: 4.5.4	commit \| commitdiff \| tree
2011-03-21	Rossen Apostolov	Fixed more real/double issues in gmx_density	commit \| commitdiff \| tree
2011-03-21	Rossen Apostolov	Removed duplicated EXTRA_DIST entry in src/tools/Makefiles.am	commit \| commitdiff \| tree
2011-03-21	Rossen Apostolov	Added back Template.mak.	commit \| commitdiff \| tree
2011-03-21	Rossen Apostolov	Removed some template files from installation.	commit \| commitdiff \| tree
2011-03-14	Rossen Apostolov	g_options source files are now properly packaged	commit \| commitdiff \| tree
2010-12-16	Rossen Apostolov	Another test commit	commit \| commitdiff \| tree
2010-12-15	Rossen Apostolov	Test commit	commit \| commitdiff \| tree
2010-11-09	Rossen Apostolov	New maintanance release: 4.5.3	commit \| commitdiff \| tree
2010-11-08	Rossen Apostolov	Reverting back GMX_DLOPEN to default ON	commit \| commitdiff \| tree
2010-11-08	Rossen Apostolov	Disable GMX_DLOPEN by default.	commit \| commitdiff \| tree
2010-11-08	Rossen Apostolov	Added support for Altivec kernels on POWERPC.	commit \| commitdiff \| tree
2010-10-30	Rossen Apostolov	Added back the "-dev" suffixes to the version strings.	commit \| commitdiff \| tree
2010-10-30	Rossen Apostolov	New bugfix release: 4.5.2	commit \| commitdiff \| tree
2010-10-30	Rossen Apostolov	For MPI builds, CMake will first try to compile a sample...	commit \| commitdiff \| tree
2010-10-29	Rossen Apostolov	added g_kinetics to the CMake build scripts	commit \| commitdiff \| tree
2010-09-25	Rossen Apostolov	Reverted changes to md_openmm.c, get rid of 'nan' in...	commit \| commitdiff \| tree
2010-09-25	Rossen Apostolov	mdrun-gpu now doesn't output individual energy term...	commit \| commitdiff \| tree
2010-09-21	Rossen Apostolov	Fixed missing installation of the openmm_api_wrapper...	commit \| commitdiff \| tree
2010-09-20	Rossen Apostolov	Added do_multiprot in src/contrib, thanks to Ran Friedman	commit \| commitdiff \| tree
2010-09-13	Rossen Apostolov	Added dependencies for openmm_api_wrapper	commit \| commitdiff \| tree
2010-09-13	Rossen Apostolov	Added library dependency for gmx_gpu_utils	commit \| commitdiff \| tree
2010-09-07	Rossen Apostolov	Merge branch 'release-4-5-patches'	commit \| commitdiff \| tree
2010-09-06	Rossen Apostolov	Added a note that running in double precision is slower.	commit \| commitdiff \| tree
2010-09-06	Rossen Apostolov	A lot of CMake options are now marked as advanced since...	commit \| commitdiff \| tree
2010-09-02	Rossen Apostolov	Another missing CMake file.	commit \| commitdiff \| tree
2010-09-02	Rossen Apostolov	Merge branch 'release-4-5-patches'	commit \| commitdiff \| tree
2010-09-02	Rossen Apostolov	Updated the version numbers to 4.5.1.	commit \| commitdiff \| tree
2010-09-02	Rossen Apostolov	Added for distribution missing CMake specific files.	commit \| commitdiff \| tree
2010-09-01	Rossen Apostolov	New release: 4.5 (final). Yay!!!	commit \| commitdiff \| tree
2010-09-01	Rossen Apostolov	Added g_rmsdist and g_rotmat to the CMake build system	commit \| commitdiff \| tree
2010-09-01	Rossen Apostolov	Small update of the GPU related documentation.	commit \| commitdiff \| tree
2010-09-01	Rossen Apostolov	Small update of the GPU related documentation.	commit \| commitdiff \| tree
2010-09-01	Rossen Apostolov	Merge branch 'release-4-5-patches' of git.gromacs.org...	commit \| commitdiff \| tree
2010-09-01	Rossen Apostolov	Merge branch 'release-4-5-patches' of git.gromacs.org...	commit \| commitdiff \| tree
2010-08-31	Rossen Apostolov	Merge branch 'release-4-5-patches' of git.gromacs.org...	commit \| commitdiff \| tree
2010-08-31	Rossen Apostolov	OpenMM now accepts cut-off method, since it's needed...	commit \| commitdiff \| tree
2010-08-27	Rossen Apostolov	New release 4.5-beta4	commit \| commitdiff \| tree
2010-08-26	Rossen Apostolov	Modified the OpenMM wrapper interface to support the...	commit \| commitdiff \| tree
2010-08-26	Rossen Apostolov	Added the g_pme_error tool from Florian Dommert. Thanks!	commit \| commitdiff \| tree
2010-08-26	Rossen Apostolov	Fixed hardcoded OpenMM library name.	commit \| commitdiff \| tree
2010-08-26	Rossen Apostolov	Removed the unnecessary hacks from some boolean statements.	commit \| commitdiff \| tree
2010-08-25	Rossen Apostolov	Merge branch 'release-4-5-patches'	commit \| commitdiff \| tree
2010-08-25	Rossen Apostolov	Redefine the default boolean type to gmx_bool.	commit \| commitdiff \| tree
2010-08-23	Rossen Apostolov	Merge branch 'release-4-5-patches' of git.gromacs.org...	commit \| commitdiff \| tree
next

Local GROMACS mirror with custom stuff

RSS Atom