dynamic disulfides are working again in md
[unres.git] / source / unres / src_MD /
2013-02-15 Cezary Czaplewskidynamic disulfides are working again in md
2013-02-15 Cezary Czaplewskiadding ename to statout with PRINT_COMPON
2013-02-15 Cezary CzaplewskiMULTCONF is working now
2013-02-15 Cezary Czaplewskierror message when reading SCCOR corrected
2013-02-15 Cezary Czaplewskiss_dyn compiles with make and with cmake
2013-02-15 Cezary Czaplewskidynamic SS from old Maurizio's code
2012-11-23 Dawid Jagielagfortran fixes in initialize_p.F for MPI
2012-11-23 Dawid Jagielasome gfortran warning fixes
2012-11-23 Dawid Jagielagfortran legacy standard enforcement
2012-11-05 Dawid Jagielaalignment fix in src_MD COMMON.SCCOR
2012-11-05 Dawid Jagielaalignment fixes in src_MD COMMONs
2012-10-31 Dawid JagielaCMake makro cinfo.f fix
2012-10-17 Adam Kazimierz Sie... Poprawka w Cmakelist
2012-10-17 Adam LiwoMerge branch 'adam' into devel
2012-10-17 Adam LiwoCommit 10/17/12 Adam
2012-09-20 Adam LiwoMerge branch 'devel' of mmka.chem.univ.gda.pl:unres...
2012-09-20 Adam LiwoUpdate
2012-07-19 Dawid Jagielacinfo.f generation and macro for unres MD
2012-07-18 Adam LiwoMerge branch 'devel' into adam
2012-07-18 Adam LiwoImplement minor changes on branch adam
2012-07-18 Adam Kazimierz Sie... Revert "Merge branch 'adasko' into devel"
2012-07-17 Adam Kazimierz Sie... Merge branch 'adasko' into devel
2012-07-17 Adam Kazimierz Sie... D i L aminokwasy dzialajace dla src_MD
2012-07-09 Adam Kazimierz Sie... D i L aminokwasy tuz przed testami
2012-07-06 Adam Kazimierz Sie... zmiana do DiL
2012-07-05 Adam LiwoMerge branch 'adam' into devel
2012-07-05 Adam LiwoMinor change
2012-07-05 Adam LiwoMinor change
2012-07-05 Adam Kazimierz Sie... zmiana binarki...
2012-07-05 Adam LiwoMerge branch 'adam' into devel
2012-07-05 Adam Liwo5/7/2012 by Adam
2012-07-05 Adam Kazimierz Sie... DIL zmiana w param read
2012-07-05 Adam Kazimierz Sie... hotfix of SCCOR potentials
2012-07-05 Adam Kazimierz Sie... hotfix do potencjalow AM1
2012-07-05 Adam Kazimierz Sie... Rozgrzebany DIL
2012-06-27 Adam Kazimierz Sie... Merge branch 'adasko' into devel
2012-06-27 Adam Kazimierz Sie... Wprowadzenie SCCOR do WHAMa i CLUSTROWNIA
2012-06-20 Dawid JagielaLAM/MPI boot ctest modification
2012-06-18 Dawid Jagielaresolving merge conflicts
2012-06-18 Adam LiwoMerge branch 'devel' of mmka.chem.univ.gda.pl:unres...
2012-06-18 Adam LiwoMerge branch 'adam' into devel
2012-06-18 Dawid Jagielafixed indent for gfortran build in source/unres/src_MD...
2012-06-18 Adam Kazimierz Sie... Merge branch 'adasko' into devel
2012-06-18 Adam Kazimierz Sie... zmiany po usunieciu diagnostyki...
2012-06-15 Adam Kazimierz Sie... dzialajacy grad check....
2012-06-14 Adam Liwo6/14/12 by Adam - changes committed
2012-06-14 Adam Liwo6/14/2012 by Adam
2012-06-14 Adam Kazimierz Sie... Dzialajacy INTERTYP=1 i INTERTYP=2
2012-06-11 Adam Liwo6/11/2012 by Adam
2012-06-11 Dawid Jagielafix of xdrf2ang
2012-06-11 Adam Liwo6/11/2012 Changes of the CSA version
2012-06-11 Adam Liwo6/11/2012 Update of the CSA version
2012-06-08 Dawid Jagielaadded ctest/1LE1_mremd_MD000.cx for xdrf2pdb-m testing
2012-06-05 Dawid JagielaUNRES single MD for MPI ctest file permissions fix
2012-06-05 Adam Kazimierz Sie... UDALO SIE TERAZ DEBUG
2012-06-05 Dawid Jagielaadded MPI ctest for unres single MD
2012-05-29 Adam Kazimierz Sie... kolejna
2012-05-29 Adam Kazimierz Sie... zmienionwe zostaly i zostal chyba tylko int to cart...
2012-05-29 Adam Kazimierz Sie... sadas
2012-05-26 Dawid JagielaEOF warning fix
2012-05-26 Dawid Jagielacompinfo.c rewrite
2012-05-26 Dawid Jagielavoid cast on fgets & fscanf in compinfo.c
2012-05-26 Dawid Jagielacompinfo.c warning supresion
2012-05-16 Dawid Jagielaadded CMake files to build cluster/wham/src-M
2012-05-14 Dawid Jagielaadded cmake files to build source/wham/src under ifort
2012-05-14 Dawid Jagielafixed more typos
2012-05-14 Dawid Jagielafixed typo
2012-05-14 Dawid Jagielaprng_32.F/prng.f fix for intel compiler
2012-05-14 Dawid Jagiela1) moved xdrf library to source/lib/xdrf - CMake files...
2012-05-13 Adam Liwo5/13/2012 by Adam
2012-05-13 Adam Liwo5/13/2012 by Adam
2012-05-11 Dawid Jagielaadded/modified CMake files for all subdirs in source...
2012-05-10 Dawid Jagielaclosing asci-art frames in energy_p_new_barrier.F files...
2012-05-10 Dawid Jagiela- added UNRES Multichain examples
2012-05-10 Dawid Jagielaadded 32/64-bit architecture detection
2012-05-10 Adam Liwo5/10/2012 by Adam
2012-05-09 Dawid Jagielasrc_MD-M CMake build files + junkfiles cleanup
2012-05-08 Dawid Jagielafixed test_single_ala.sh to run binary from current...
2012-05-08 Dawid Jagielafixed "rm tmptmp" of notexisting file in compinfo.c
2012-05-07 Dawid Jagielanew gfortran fix
2012-05-07 Dawid Jagielafixed ctest/cmake files for src_MD build
2012-04-23 Dawid JagielaAdded test MPI preprocessor compile definitions
2012-04-19 Dawid JagielaRevert "Revert "CMake file for xdrf library""
2012-04-19 Dawid JagielaRevert "CMake file for xdrf library"
2012-04-19 Dawid JagielaCMake file for xdrf library
2012-04-19 Dawid JagielaCMake project files added
2012-04-02 Adam LiwoNew files added
2012-04-02 Adam LiwoMakefiles for specific compilers and force fields created
2012-03-29 Adam LiwoUnnecessary object files removed
2012-03-29 Adam LiwoMakefile_single_gfortran_oldparm corrected to include...
2012-03-28 Cezary Czaplewskifinal changes to remove CSA from MD version of the...
2012-03-28 Cezary Czaplewskiremoval of CSA from MD version of code
2012-03-28 Cezary Czaplewskiold unecessary files are deleted
2012-02-25 Dawid Jagiełaadded source code v.3.0