switched to CMake FindMPI module in all source files that use MPI
[unres.git] / source / unres / src_MD /
2014-10-26 Dawid Jagielaswitched to CMake FindMPI module in all source files...
2014-10-26 Dawid Jagielaadded missing preprocessor flags for prng_32.F
2014-10-25 Dawid Jagielaprng.f unification
2013-11-05 Adam SieradzanDebug part 1
2013-08-31 Adam Kazimierz Sie... wylaczenie diagnostyki
2013-08-31 Adam Kazimierz Sie... zmiany w prereleasie drobne
2013-05-07 Cezary Czaplewskisome corrections in xdrf2pdb-m for dyn_ss
2013-04-08 Cezary Czaplewskicorrect writing of dyn_ss for cx and x
2013-02-19 Cezary Czaplewskidyn_ss and other finegrain printout cleaning
2013-02-18 Cezary Czaplewskidynamic dissulfides with finegrain parallelization...
2013-02-18 Cezary Czaplewskidynamic dissulfides with finegrain parallelization
2013-02-18 Adam Liwo8/11/12 by Adam: fixed disulfide bridge problems
2013-02-18 Cezary Czaplewskicompilation only
2013-02-17 Adam LiwoFixed the addition of dummy chain ends to structures...
2013-02-17 Cezary Czaplewskidyn_ss writing pdb and ihpb cleaning
2013-02-16 Cezary Czaplewskino type declaration in common
2013-02-16 Cezary Czaplewskiclassical Makefile cleaning
2013-02-16 Cezary Czaplewskiprng and not prng_32 for gfortran
2013-02-16 Cezary Czaplewski prng and not prng_32 for f95
2013-02-16 Cezary Czaplewskinew SCCORPAR for ctest
2013-02-16 Cezary Czaplewskicommon reorder to avoid padding in gfortran
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
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