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

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2019-10-02	Paul Bauer	Prepare for 2019.5	commit \| commitdiff \| tree
2019-10-02	Paul Bauer	GROMACS version 2019.4	commit \| commitdiff \| tree
2019-10-01	Paul Bauer	Fix chain ID handling in make_ndx	commit \| commitdiff \| tree
2019-07-09	Paul Bauer	Fix link to acpype repository	commit \| commitdiff \| tree
2019-07-08	Paul Bauer	Fix issues found by clang-tidy 7	commit \| commitdiff \| tree
2019-07-02	Paul Bauer	Fix bug in gmx xpm2ps	commit \| commitdiff \| tree
2019-06-14	Paul Bauer	Prepare for 2019.4	commit \| commitdiff \| tree
2019-06-14	Paul Bauer	Version 2019.3	commit \| commitdiff \| tree
2019-06-14	Paul Bauer	Merge branch release-2018 into release-2019	commit \| commitdiff \| tree
2019-06-12	Paul Bauer	Fix qsort not being defined on Apple Clang	commit \| commitdiff \| tree
2019-06-11	Paul Bauer	Fix residue and molecule indexing in selections	commit \| commitdiff \| tree
2019-06-11	Paul Bauer	Extend information for gmxcpp syntax error.	commit \| commitdiff \| tree
2019-06-11	Paul Bauer	Add check for too many grid points in hbond	commit \| commitdiff \| tree
2019-05-29	Paul Bauer	Version 2018.7	commit \| commitdiff \| tree
2019-05-27	Paul Bauer	Add more info for wrong line endings	commit \| commitdiff \| tree
2019-05-24	Paul Bauer	Fix PQR formatting	commit \| commitdiff \| tree
2019-05-24	Paul Bauer	Fix membrane embedding	commit \| commitdiff \| tree
2019-05-23	Paul Bauer	Add check for allocating too many interactions	commit \| commitdiff \| tree
2019-05-13	Paul Bauer	Prepare for 2018.7	commit \| commitdiff \| tree
2019-05-02	Paul Bauer	Fix FPE in do_steep	commit \| commitdiff \| tree
2019-04-16	Paul Bauer	Prepare for version 2019.3	commit \| commitdiff \| tree
2019-04-16	Paul Bauer	Version 2019.2	commit \| commitdiff \| tree
2019-04-16	Paul Bauer	Fix off-by-one error in gmx cluster	commit \| commitdiff \| tree
2019-04-04	Paul Bauer	Fix segmentation fault with simulated annealing	commit \| commitdiff \| tree
2019-03-12	Paul Bauer	Fix formatting error in user guide reference	commit \| commitdiff \| tree
2019-03-06	Paul Bauer	Add error when manual cannot be built	commit \| commitdiff \| tree
2019-02-20	Paul Bauer	Version 2018.6	commit \| commitdiff \| tree
2019-02-20	Paul Bauer	Fix release notes formatting	commit \| commitdiff \| tree
2019-02-19	Paul Bauer	Prepare for 2019.2	commit \| commitdiff \| tree
2019-02-19	Paul Bauer	Change icc-18 to no-hwloc	commit \| commitdiff \| tree
2019-02-15	Paul Bauer	Version 2019.1	commit \| commitdiff \| tree
2019-02-15	Paul Bauer	Fix tune_pme	commit \| commitdiff \| tree
2019-02-13	Paul Bauer	Move simulated tempering default setting	commit \| commitdiff \| tree
2019-01-24	Paul Bauer	Change gcov to run on bs-mic	commit \| commitdiff \| tree
2019-01-23	Paul Bauer	Change gcov to run on bs-mic	commit \| commitdiff \| tree
2019-01-22	Paul Bauer	Prepare for 2018.6	commit \| commitdiff \| tree
2019-01-22	Paul Bauer	Version 2018.5	commit \| commitdiff \| tree
2019-01-16	Paul Bauer	Fix memory leak in solvate	commit \| commitdiff \| tree
2019-01-07	Paul Bauer	Remove DOI entries when not on release patch	commit \| commitdiff \| tree
2018-12-31	Paul Bauer	Prepare for 2019.1	commit \| commitdiff \| tree
2018-12-31	Paul Bauer	GROMACS 2019 release	commit \| commitdiff \| tree
2018-12-31	Paul Bauer	Merge branch release-2018 into release-2019	commit \| commitdiff \| tree
2018-12-27	Paul Bauer	Document OpenCL timer issue.	commit \| commitdiff \| tree
2018-12-22	Paul Bauer	Fix mdrun -nb GPU on non-gpu builds	commit \| commitdiff \| tree
2018-12-17	Paul Bauer	Add matrix entry to test external FFTW build	commit \| commitdiff \| tree
2018-12-17	Paul Bauer	Fix FFTW build	commit \| commitdiff \| tree
2018-12-17	Paul Bauer	Copy parallelisation info from old webpage	commit \| commitdiff \| tree
2018-12-17	Paul Bauer	Merge branch release-2018 into release-2019	commit \| commitdiff \| tree
2018-12-14	Paul Bauer	GROMACS 2019 Release candidate	commit \| commitdiff \| tree
2018-12-11	Paul Bauer	Properly check for MSVC in build script	commit \| commitdiff \| tree
2018-12-10	Paul Bauer	Disable gmxapi by default	commit \| commitdiff \| tree
2018-12-10	Paul Bauer	Make release notes html only	commit \| commitdiff \| tree
2018-12-10	Paul Bauer	Change toctree depth in PDF manual	commit \| commitdiff \| tree
2018-12-03	Paul Bauer	Fix energy history reading	commit \| commitdiff \| tree
2018-11-30	Paul Bauer	Recreate flowchart figure	commit \| commitdiff \| tree
2018-11-29	Paul Bauer	More fixes for ImageMagick test script	commit \| commitdiff \| tree
2018-11-29	Paul Bauer	Fix energy history reading	commit \| commitdiff \| tree
2018-11-29	Paul Bauer	Make Imagemagick availability more visible	commit \| commitdiff \| tree
2018-11-29	Paul Bauer	Fix reference manual image sizes	commit \| commitdiff \| tree
2018-11-29	Paul Bauer	Fix reference manual doc build	commit \| commitdiff \| tree
2018-11-28	Paul Bauer	Fix gcc-8 warnings	commit \| commitdiff \| tree
2018-11-26	Paul Bauer	Fix newline printing in -v output	commit \| commitdiff \| tree
2018-11-22	Paul Bauer	Prepare for 2019 release candidate	commit \| commitdiff \| tree
2018-11-22	Paul Bauer	GROMACS 2019 third beta release	commit \| commitdiff \| tree
2018-11-21	Paul Bauer	Merge branch release-2018 into release-2019	commit \| commitdiff \| tree
2018-11-15	Paul Bauer	Refine FindSphinx	commit \| commitdiff \| tree
2018-11-15	Paul Bauer	Rework GMXAPI tests	commit \| commitdiff \| tree
2018-11-12	Paul Bauer	Update to prepare for 2018.5 point release	commit \| commitdiff \| tree
2018-11-12	Paul Bauer	Version 2018.4	commit \| commitdiff \| tree
2018-11-08	Paul Bauer	Give error when rerun with identical file names	commit \| commitdiff \| tree
2018-11-08	Paul Bauer	Issue fatal error if checkpoint does not suit the .tpr	commit \| commitdiff \| tree
2018-11-08	Paul Bauer	Actually fix gmx helix segmentation fault	commit \| commitdiff \| tree
2018-11-07	Paul Bauer	Mark new cmake variables advanced	commit \| commitdiff \| tree
2018-11-07	Paul Bauer	Add global directory for simulation test inputs	commit \| commitdiff \| tree
2018-11-06	Paul Bauer	Fix wrong branch for regressiontests	commit \| commitdiff \| tree
2018-11-06	Paul Bauer	Prepare for beta3	commit \| commitdiff \| tree
2018-11-06	Paul Bauer	GROMACS 2019 second beta release	commit \| commitdiff \| tree
2018-11-05	Paul Bauer	Fix non ascii characters in manual references	commit \| commitdiff \| tree
2018-11-05	Paul Bauer	Make QM/MM code always compile	commit \| commitdiff \| tree
2018-11-05	Paul Bauer	Give more info when trying to build manual	commit \| commitdiff \| tree
2018-11-05	Paul Bauer	Fix formatting issue	commit \| commitdiff \| tree
2018-11-01	Paul Bauer	Properly define Bromine in amber forcefields	commit \| commitdiff \| tree
2018-10-31	Paul Bauer	Add equation numbers in reference manual	commit \| commitdiff \| tree
2018-10-30	Paul Bauer	Change Table of contents depth	commit \| commitdiff \| tree
2018-10-26	Paul Bauer	Fix link formatting in developer manual	commit \| commitdiff \| tree
2018-10-26	Paul Bauer	Update user documentation overview	commit \| commitdiff \| tree
2018-10-25	Paul Bauer	Change doc build without image conversion	commit \| commitdiff \| tree
2018-10-24	Paul Bauer	Update QM gaussian interface	commit \| commitdiff \| tree
2018-10-24	Paul Bauer	Fix MPI w/o MPI_IN_PLACE	commit \| commitdiff \| tree
2018-10-22	Paul Bauer	Prepare for beta 2	commit \| commitdiff \| tree
2018-10-22	Paul Bauer	GROMACS 2019 first beta release	commit \| commitdiff \| tree
2018-10-18	Paul Bauer	Remove unused files in docs/manual	commit \| commitdiff \| tree
2018-10-18	Paul Bauer	Fix segmentation fault in gmx helix	commit \| commitdiff \| tree
2018-10-11	Paul Bauer	Add short security notice	commit \| commitdiff \| tree
2018-10-10	Paul Bauer	Include doi strings from zenodo during release	commit \| commitdiff \| tree
2018-10-10	Paul Bauer	Wrong name for report-methods tool	commit \| commitdiff \| tree
2018-10-08	Paul Bauer	Workaround for ICC postsubmit bug	commit \| commitdiff \| tree
2018-10-03	Paul Bauer	Change acceptable precision in minimizer test	commit \| commitdiff \| tree
2018-10-03	Paul Bauer	Disable GMXAPI when only building mdrun	commit \| commitdiff \| tree
2018-10-02	Paul Bauer	Fix include formatting in gmxapi	commit \| commitdiff \| tree
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