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wham with mpich2 (no aliasing) and new dimenstions
[unres.git] / source / unres /
2013-05-07 Cezary Czaplewskisome corrections in xdrf2pdb-m for dyn_ss tree | commitdiff
2013-04-08 Cezary Czaplewskicorrect writing of dyn_ss for cx and x tree | commitdiff
2013-02-19 Cezary Czaplewskidyn_ss and other finegrain printout cleaning tree | commitdiff
2013-02-18 Cezary Czaplewskidynamic dissulfides with finegrain parallelization... tree | commitdiff
2013-02-18 Cezary CzaplewskiMerge branch 'prerelease-3.2.1' of mmka:unres into... tree | commitdiff
2013-02-18 Cezary Czaplewskidynamic dissulfides with finegrain parallelization tree | commitdiff
2013-02-18 Adam LiwoAdded refsys.f to src_CSA_DiL tree | commitdiff
2013-02-18 Adam Liworefsys deleted from readpdb.F in srd_CSA_DiL tree | commitdiff
2013-02-18 Adam LiwoAdded refsysy to Cmakelists tree | commitdiff
2013-02-18 Adam Liwo8/11/12 by Adam: fixed disulfide bridge problems tree | commitdiff
2013-02-18 Cezary Czaplewskicompilation only tree | commitdiff
2013-02-17 Adam LiwoFixed the addition of dummy chain ends to structures... tree | commitdiff
2013-02-17 Cezary Czaplewskidyn_ss writing pdb and ihpb cleaning tree | commitdiff
2013-02-16 Cezary Czaplewskimore type cleaning in DFA tree | commitdiff
2013-02-16 Cezary Czaplewskitype declaration in COMMON.DFA tree | commitdiff
2013-02-16 Cezary Czaplewskino type declaration in common tree | commitdiff
2013-02-16 Cezary Czaplewskino type declaration in common tree | commitdiff
2013-02-16 Cezary Czaplewskiclassical Makefile cleaning tree | commitdiff
2013-02-16 Cezary Czaplewskirename common sccorin src_CSA tree | commitdiff
2013-02-16 Cezary Czaplewskisrc_MD-M compiles with old Makefile and common sccor... tree | commitdiff
2013-02-16 Cezary Czaplewskicommon name correction tree | commitdiff
2013-02-16 Cezary Czaplewskiprng and not prng_32 for gfortran tree | commitdiff
2013-02-16 Cezary Czaplewski prng and not prng_32 for f95 tree | commitdiff
2013-02-16 Cezary Czaplewskinew SCCORPAR for ctest tree | commitdiff
2013-02-16 Cezary Czaplewskicommon reorder to avoid padding in gfortran tree | commitdiff
2013-02-15 Cezary Czaplewskidynamic disulfides are working again in md tree | commitdiff
2013-02-15 Cezary Czaplewskiadding ename to statout with PRINT_COMPON tree | commitdiff
2013-02-15 Cezary CzaplewskiMULTCONF is working now tree | commitdiff
2013-02-15 Cezary Czaplewskierror message when reading SCCOR corrected tree | commitdiff
2013-02-15 Cezary Czaplewskiss_dyn compiles with make and with cmake tree | commitdiff
2013-02-15 Cezary Czaplewskidynamic SS from old Maurizio's code tree | commitdiff
2013-02-14 Cezary Czaplewskicompilation only tree | commitdiff
2012-12-19 Dawid Jagielapoprawki w COMMONAch tree | commitdiff
2012-11-23 Dawid Jagielagfortran fixes in local_move.f, energy_p_new.F & initia... tree | commitdiff
2012-11-23 Dawid Jagielagfortran foxes in src_CSA/energy_p_new_barrier.F, src_C... tree | commitdiff
2012-11-23 Dawid Jagielafixed typos in initialize_p.F tree | commitdiff
2012-11-23 Dawid Jagielagfortran fixes in src_CSA for initialize_p.F tree | commitdiff
2012-11-23 Dawid Jagielagfortran fixes for src_MD-M tree | commitdiff
2012-11-23 Dawid Jagielafix 80 column in initialize_p.F tree | commitdiff
2012-11-23 Dawid Jagielagfortran fixes in initialize_p.F for src_MD-M tree | commitdiff
2012-11-23 Dawid Jagielaalignment fixes in COMMON.CHAIN for src_MD-M tree | commitdiff
2012-11-23 Dawid Jagielagfortran fixes in initialize_p.F for MPI tree | commitdiff
2012-11-23 Dawid Jagielasome gfortran warning fixes tree | commitdiff
2012-11-23 Dawid Jagielaforce legacy standard for gfortran tree | commitdiff
2012-11-23 Dawid Jagielagfortran legacy standard enforcement tree | commitdiff
2012-11-05 Dawid Jagielaalignment fix in src_MD COMMON.SCCOR tree | commitdiff
2012-11-05 Dawid Jagielaalignment fixes in src_MD COMMONs tree | commitdiff
2012-10-31 Dawid JagielaCMake makro cinfo.f fix tree | commitdiff
2012-10-30 Dawid JagielaCMake unres/src_MIN missing sources fix tree | commitdiff
2012-10-17 Adam Kazimierz Sie... Poprawka w Cmakelist tree | commitdiff
2012-10-17 Adam Liwo10/17/2012 by Adam: Implemented sideadd correction... tree | commitdiff
2012-10-17 Adam LiwoMerge branch 'devel' of mmka.chem.univ.gda.pl:unres... tree | commitdiff
2012-10-17 Adam LiwoMerge branch 'adam' into devel tree | commitdiff
2012-10-17 Adam LiwoCommit 10/17/12 Adam tree | commitdiff
2012-10-06 Bartlomiej ZaborowskiSmall changes in source src_CSA_DiL. Compilation works now tree | commitdiff
2012-10-03 Bartlomiej ZaborowskiFixed Cmake variable tree | commitdiff
2012-10-03 Bartlomiej Zaborowski1. Fixed merge conflicts tree | commitdiff
2012-10-02 Bartlomiej ZaborowskiMerge branch 'bartek' into devel tree | commitdiff
2012-10-02 Bartlomiej ZaborowskiMerge branch 'bartek2' into bartek tree | commitdiff
2012-10-02 Bartlomiej Zaborowskizmiana do DiL tree | commitdiff
2012-10-02 Bartlomiej ZaborowskiRozgrzebany DIL tree | commitdiff
2012-10-02 Bartlomiej ZaborowskiD i L aminokwasy dzialajace dla src_CSA tree | commitdiff
2012-10-01 Adam LiwoCommit 10/1/12 tree | commitdiff
2012-09-26 Bartlomiej Zaborowski"DiL zmiana w param read i tuz przed testami" tree | commitdiff
2012-09-26 Bartlomiej Zaborowski"Przygotowanie CSA do D i L aminokwasow" tree | commitdiff
2012-09-20 Adam LiwoMerge branch 'devel' of mmka.chem.univ.gda.pl:unres... tree | commitdiff
2012-09-20 Adam LiwoUpdate tree | commitdiff
2012-09-20 Adam LiwoSept 20/2012 by Adam: commit changes mostly in the... tree | commitdiff
2012-08-20 Dawid Jagiela1. cmake cinfo.f generation for all sources 2. deleted... tree | commitdiff
2012-08-08 Bartlomiej ZaborowskiCASP3 force field deleted. Fixed merge conflicts. tree | commitdiff
2012-08-08 Bartlomiej ZaborowskiOld force fields removed, new ones (GAB, E0LL2Y) added. tree | commitdiff
2012-07-19 Dawid Jagielacinfo.f generation and macro for unres MD tree | commitdiff
2012-07-18 Adam LiwoMerge branch 'devel' into adam tree | commitdiff
2012-07-18 Adam LiwoImplement minor changes on branch adam tree | commitdiff
2012-07-18 Adam Kazimierz Sie... Revert "Merge branch 'adasko' into devel" tree | commitdiff
2012-07-17 Adam Kazimierz Sie... Merge branch 'adasko' into devel tree | commitdiff
2012-07-17 Adam Kazimierz Sie... D i L aminokwasy dzialajace dla src_MD tree | commitdiff
2012-07-09 Adam Kazimierz Sie... D i L aminokwasy tuz przed testami tree | commitdiff
2012-07-06 Adam Kazimierz Sie... zmiana do DiL tree | commitdiff
2012-07-05 Adam LiwoMerge branch 'adam' into devel tree | commitdiff
2012-07-05 Adam LiwoMinor change tree | commitdiff
2012-07-05 Adam LiwoMinor change tree | commitdiff
2012-07-05 Adam Kazimierz Sie... zmiana binarki... tree | commitdiff
2012-07-05 Adam LiwoMerge branch 'adam' into devel tree | commitdiff
2012-07-05 Adam Liwo5/7/2012 by Adam tree | commitdiff
2012-07-05 Adam Kazimierz Sie... DIL zmiana w param read tree | commitdiff
2012-07-05 Adam Kazimierz Sie... hotfix of SCCOR potentials tree | commitdiff
2012-07-05 Adam Kazimierz Sie... hotfix do potencjalow AM1 tree | commitdiff
2012-07-05 Adam Kazimierz Sie... Rozgrzebany DIL tree | commitdiff
2012-06-27 Adam Kazimierz Sie... Merge branch 'adasko' into devel tree | commitdiff
2012-06-27 Adam Kazimierz Sie... Wprowadzenie SCCOR do WHAMa i CLUSTROWNIA tree | commitdiff
2012-06-20 Dawid JagielaLAM/MPI boot ctest modification tree | commitdiff
2012-06-19 Dawid Jagielaadded -cpp flag to force preprocesing for all files... tree | commitdiff
2012-06-19 Dawid JagielaMoved ifdef MOMENT part from COMMON.CONTACTS to COMMON... tree | commitdiff
2012-06-18 Dawid Jagielaenable compiler preprocesor flags for non-standard... tree | commitdiff
2012-06-18 Dawid Jagielafixed merge conflict in readrtns_csa.F tree | commitdiff
2012-06-18 Dawid Jagielafixed merge renamed source file: newconf.f is now newconf.F tree | commitdiff
2012-06-18 Dawid Jagielaresolving merge conflicts tree | commitdiff
2012-06-18 Adam LiwoMerge branch 'devel' of mmka.chem.univ.gda.pl:unres... tree | commitdiff
2012-06-18 Adam LiwoMerge branch 'adam' into devel tree | commitdiff
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