pierwsza proba merga devela do adasko
[unres.git] / source /
2013-11-05 Adam Sieradzanpierwsza proba merga devela do adasko
2013-11-05 Adam SieradzanDostosowanie w src whama i clustra
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
2013-07-25 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 Jagielafixed WHAM for gfortran: src/energy_p_new.F
2013-07-16 Adam SieradzanNIE PEWNE ZMIANY ZWERYFIKUJ!!
2013-06-28 Adam Kazimierz Sie... Just few comments added to WHAM to clarify
2013-06-28 Adam Kazimierz Sie... Bugfix for SS wham and introduction SS to cluster analysis
2013-06-25 Adam Kazimierz Sie... Dodanie dynamic disulfide to WHAM
2013-05-07 Cezary Czaplewskisome corrections in xdrf2pdb-m for dyn_ss
2013-04-30 Cezary CzaplewskiMerge branch 'prerelease-3.2.1' of mmka:unres into...
2013-04-30 Cezary Czaplewskitesting ssbond in cx
2013-04-15 Dawid Jagielachanged SCCORPAR to shelly potentials in GAB & 12LY...
2013-04-12 Dawid Jagielaadded default preprocessor flags for unknown compilers
2013-04-11 Dawid Jagielaadded REMD/MREMD input generation in UNRESInpGen.py
2013-04-08 Cezary Czaplewskicorrect writing of dyn_ss for cx and x
2013-03-07 Dawid Jagielaadded OVERLAP and NOSEARCHSC options in UNRESInpGen.py
2013-03-06 Dawid JagielaAdded minimazation support to UNRESInpGen.py
2013-03-05 Dawid Jagielaadded glicyne support in show_UNRES.py
2013-02-28 Dawid JagielaMerge branch 'devel' of mmka:unres into devel
2013-02-28 Dawid Jagielafixed ray-tracing bug and size of ellipoids in show_UNR...
2013-02-19 Cezary Czaplewskicleaning of gfortran warnings in src_MD_DFA
2013-02-19 Cezary Czaplewskicleaning of gfortran warnings
2013-02-19 Cezary Czaplewskicopy DFA cleaning of types from CSA to MD
2013-02-19 Cezary Czaplewskirepairs error in merge
2013-02-19 Cezary CzaplewskiMerge branch 'prerelease-3.2.1' into devel
2013-02-19 Cezary Czaplewskidyn_ss and other finegrain printout cleaning
2013-02-18 Cezary Czaplewskidynamic dissulfides with finegrain parallelization...
2013-02-18 Cezary CzaplewskiMerge branch 'prerelease-3.2.1' of mmka:unres into...
2013-02-18 Cezary Czaplewskidynamic dissulfides with finegrain parallelization
2013-02-18 Adam LiwoAdded refsys.f to src_CSA_DiL
2013-02-18 Adam LiwoAdded refsys,f
2013-02-18 Adam Liworefsys deleted from readpdb.F in srd_CSA_DiL
2013-02-18 Adam Liworefsys separated from readpdb in src_CDA_DiL
2013-02-18 Adam LiwoAdded refsysy to Cmakelists
2013-02-18 Adam Liwo8/11/12 by Adam: fixed disulfide bridge problems
2013-02-18 Cezary Czaplewskicompilation only
2013-02-17 Adam LiwoFixed addition of dummy residues for input UNRES pdb...
2013-02-17 Adam Liwoadded files deleted by merge with devel
2013-02-17 Adam LiwoFixed the addition of dummy chain ends to structures...
2013-02-17 Adam LiwoMerge branch 'devel' of mmka.chem.univ.gda.pl:unres...
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 Czaplewskimore type cleaning in DFA
2013-02-16 Cezary Czaplewskitype declaration in COMMON.DFA
2013-02-16 Cezary Czaplewskino type declaration in common
2013-02-16 Cezary Czaplewskino type declaration in common
2013-02-16 Cezary Czaplewskicommon sccor rename to avoid conflict with torsion
2013-02-16 Cezary Czaplewskiclassical Makefile cleaning
2013-02-16 Cezary Czaplewskirename common sccorin src_CSA
2013-02-16 Cezary Czaplewskisrc_MD-M compiles with old Makefile and common sccor...
2013-02-16 Cezary Czaplewskicommon name correction
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
2013-02-16 Cezary Czaplewskismall changes to compile 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
2013-02-14 Cezary Czaplewskicompilation only
2013-02-10 Dawid Jagielaadded UNRES visualization plugin for PyMOL
2013-02-07 Bartlomiej Zaborowskikosmetyczne zmiany do MD_DFA
2013-02-06 Bartlomiej ZaborowskiMerge branch 'devel' of mmka:unres into devel
2013-02-06 Bartlomiej ZaborowskiFiles to working MD_DFA
2013-02-06 Dawid Jagielaadded pymol/UNRESInpGen.py - generates inputs for MD
2013-01-10 Dawid Jagielafixed missing closing bracket
2013-01-10 Dawid JagielaWHAM -DISNAN fix
2013-01-10 Dawid Jagielaadded UNRES_MD_FF setting for WHAM in (wham & cluster...
2013-01-06 Adam SieradzanWprowadzenie do Clustrowania D-aminokwasow w polu Yi
2012-12-19 Dawid Jagielapoprawki w COMMONAch
2012-12-18 Adam SieradzanUsuniecie diagnostyki
2012-12-12 Adam Kazimierz Sie... debud OFF
2012-12-12 Adam Kazimierz Sie... Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
2012-12-12 Andrei Niadzvedtskidebug ON w MD
2012-12-12 Adam Kazimierz Sie... Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
2012-12-10 Adam Sieradzanzmiana w komonie
2012-12-10 Adam Sieradzanzmiana w COMMONIE
2012-12-06 Adam Kazimierz Sie... Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
2012-12-06 Adam Sieradzanbugfix w whamie w parmreadzie
2012-12-06 Adam Kazimierz Sie... zmiany w xdrfie
2012-12-06 Adam Sieradzanbugfix przekroczenia granic
2012-12-05 Adam Sieradzanzmaina w xdrf
2012-12-04 Adam Sieradzanbugfix w contact parm
2012-12-03 Andrei NiadzvedtskiZmiany w COMMONach
2012-12-03 Adam Kazimierz Sie... poprawka w liczbie ntyp
2012-12-03 Andrei NiadzvedtskiZmiana w wham-m dla pola Yi
2012-12-03 Adam Kazimierz Sie... Zmiany do WHAM-M dla pola Yi
2012-11-30 Adam Sieradzanzmiana w symetry (bugfix)
2012-11-26 Adam Kazimierz Sie... Usuniecie diagnostyki w dzialajacym polu yi src_MD-M
2012-11-23 Dawid Jagielagfortran fixes in local_move.f, energy_p_new.F & initia...
2012-11-23 Adam Kazimierz Sie... Dzialajace gradient dla src_MD-M dla pola Yi
2012-11-23 Dawid Jagielagfortran foxes in src_CSA/energy_p_new_barrier.F, src_C...
2012-11-23 Dawid Jagielafixed typos in initialize_p.F
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