correction in multichain
[unres.git] / source /
2015-03-04 Adam Sieradzancorrection in multichain
2015-02-24 Adam SieradzanMerge branch 'master' into multichain
2014-12-17 Adam SieradzanMerge branch 'master' of mmka:unres
2014-12-17 Adam SieradzanMerge branch 'master' of mmka:unres into multichain
2014-12-11 Adam LiwoUpdated changelog, added minimization-only version...
2014-12-11 Adam LiwoCreated binaries and fixed bugs when compiling single...
2014-12-05 Cezary Czaplewskinew options for mpich2 with gfortran Makefile
2014-12-05 Cezary Czaplewskisrc_CSA_DiL removed from prerelease, current version...
2014-11-28 Dawid Jagielachanged FF preprocesor flags in src_CSA_DiL/CMakeLists.txt
2014-11-28 Dawid Jagielafixed FF preprocesor flags for src_CSA/CMakeLists.txt
2014-11-28 Dawid Jagielachanged csa.f to csa.F in src_CSA/CMakeLists.txt sources
2014-11-28 Adam LiwoTrying to bring files - continued
2014-11-27 Adam LiwoFixed Makefiles, handle all force fields thru appropria...
2014-11-05 Dawid Jagielactest ala10 binary location fix
2014-10-27 Dawid Jagiela1) binaries are compiled into /bin subdirectory of...
2014-10-26 Dawid Jagiela1) Threading cleanup in src_CSA & src_CSA_DiL
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
2014-10-23 Adam SieradzanMerge branch 'multichain' of mmka:unres into multichain
2014-10-23 Adam Sieradzanpoprawka w stochasticfric
2014-10-16 Dawid Jagiela64-bit fix for unres/CSA and unres/CSA_DiL code
2014-10-14 Dawid JagiełaMerge branch 'prerelease-3.2.1' of mmka:unres into...
2014-10-14 Dawid Jagiełafixed CMake variable typo
2014-10-08 Cezary Czaplewskicorrect default option for compilers in cluster CmakeLi...
2014-10-08 Cezary Czaplewskicorrect default option for compilers in wham CmakeList.txt
2014-09-11 Adam Kazimierz Sie... poprawka w triss
2014-09-10 Adam Sieradzancorrection of xdrf2pdb
2014-07-24 Adam Kazimierz Sie... After long DEBUG of energy function
2014-07-22 Adam Sieradzancorrection in MD returnbox
2014-06-24 Adam Sieradzanbug fix for langevin dynamics
2014-06-12 Adam Sieradzancompiling cluster before tests
2014-06-10 Adam SieradzanIntroduction of PBC to cluster energy and reading,...
2014-06-10 Adam SieradzanBug fix for reading single residue from pdb
2014-05-25 Adam Sieradzanzmiany w multichainie
2014-05-25 Adam Kazimierz Sie... zmiany, wylaczenie diagnostyki, dzialajacy WHAM
2014-05-21 Adam Kazimierz Sie... diagnoza dlaczego WHAM nie dziala
2014-05-15 Adam Kazimierz Sie... zmiany w WHAM PBC przed sprawdzeniem differow
2014-05-13 Adam SieradzanWylacznie timiningu i sprawdzenie gradientu
2014-05-12 Adam Sieradzanpo przyspieszeniu przed checkgradem i sympcheckiem
2014-05-08 Adam SieradzanAdjusted energy file (small improvement)
2014-05-01 Adam Sieradzanpolepszenie wydajnosci algorytmu PBC
2014-03-03 Adam Sieradzanpoprawka w refsysie
2014-02-24 Adam SieradzanWorking gradient for PBC
2014-02-17 Adam SieradzanThe wrong one gradient compontent...
2014-02-08 Adam Sieradzanzmiany w galezi multichain
2014-01-29 Adam SieradzanDO zmiany czytanie pisanie i cutoff
2013-11-18 Adam Sieradzandzialajacy gradient
2013-11-14 Adam SieradzanDzialajacy gradient dla reszt 13 i 7
2013-11-14 Adam Sieradzanzabezpieczenie przedczarkowe
2013-11-06 Dawid JagielaMerge branch 'devel' of mmka:unres into devel
2013-11-06 Dawid Jagielajunk files cleanup
2013-11-05 Adam SieradzanMerge branch 'devel' of mmka:unres into devel
2013-11-05 Adam SieradzanBugfix for smaller size of memory
2013-11-05 Dawid Jagiela deleted: cluster/wham/src-M/permut.o
2013-11-05 Adam SieradzanDebug part 11
2013-11-05 Adam SieradzanDebug part 10
2013-11-05 Adam SieradzanDebug part 9
2013-11-05 Adam SieradzanDebug part 8
2013-11-05 Adam SieradzanDebug cd 7
2013-11-05 Adam SieradzanDebug part 7
2013-11-05 Adam SieradzanDebug part 6
2013-11-05 Adam SieradzanDebug part 5
2013-11-05 Adam SieradzanDebug part 4
2013-11-05 Adam SieradzanDebug part 3
2013-11-05 Adam SieradzanDebug part 2
2013-11-05 Adam SieradzanDebug part 1
2013-11-05 Adam SieradzanMerge branch 'adasko' into devel
2013-11-05 Adam Sieradzanpierwsza proba merga devela do adasko
2013-11-05 Adam SieradzanDostosowanie w src whama i clustra
2013-10-30 Cezary CzaplewskiMakefile for pgi 2013
2013-10-30 Cezary CzaplewskiMerge branch 'devel' of mmka:unres into devel
2013-10-30 Cezary Czaplewskitesting Makefile for pgi compiler
2013-10-07 Adam Sieradzansmall correctian in wham
2013-09-22 Dawid Jagielashow_UNRES.py - large loops speedup by using xrange
2013-09-02 Dawid Jagielaresolved conflicts in: source/unres/src_MD/CMakeLists.txt
2013-09-02 Cezary Czaplewskirepair of broken merge
2013-09-02 Cezary CzaplewskiMerge branch 'devel' of mmka:unres into devel
2013-09-02 Cezary Czaplewskimerging devel
2013-09-02 Cezary CzaplewskiMerge branch 'prerelease-3.2.1' of mmka:unres into...
2013-09-02 Cezary Czaplewskidynamic disulfides in multichain
2013-08-31 Adam Kazimierz Sie... 1)Clean-up 2)making similar src_MD and its multichain...
2013-08-31 Adam Kazimierz Sie... Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
2013-08-31 Adam Kazimierz Sie... Clean-up in parmread for src-MD and src-MD-M
2013-08-31 Adam Kazimierz Sie... wylaczenie diagnostyki
2013-08-31 Adam Kazimierz Sie... Merge branch 'prerelease-3.2.1' of mmka.chem.univ.gda...
2013-08-31 Adam Kazimierz Sie... zmiany w prereleasie drobne
2013-08-23 Dawid JagielaFix to use native system xdr headers
2013-08-12 Adam Sieradzanchanges for DIMENSION for smaller size MEMory
2013-08-08 Adam SieradzanMerge branch 'prerelease-3.2.1' of mmka:unres into...
2013-08-07 Cezary Czaplewskidecrease of Max_Parm to 32 necessary for 4GB machine
2013-08-07 Adam Sieradzanmerge...
2013-08-07 Adam Sieradzanusuniecie diagnostyki
2013-07-25 Dawid Jagielatest name changed for unres MD DFA version
2013-07-25 Dawid Jagielatest name changed for unres MD DFA version
2013-07-25 Dawid JagielaMerge branch 'prerelease-3.2.1' into devel
2013-07-25 Dawid JagielaMerge branch 'prerelease-3.2.1' into devel
2013-07-25 Dawid Jagielafixed WHAM for gfortran: src/energy_p_new.F
2013-07-25 Dawid Jagielafixed WHAM for gfortran: src/energy_p_new.F
2013-07-16 Adam SieradzanNIE PEWNE ZMIANY ZWERYFIKUJ!!
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