correction in tube for parallel code
[unres.git] / source / wham / src-M /
2017-01-10 Adam Sieradzandodanie parametrow do nanotube
2016-07-13 Adam Sieradzanpoprawka w make (usuniecie nss)
2016-06-14 Adam Sieradzanclean in COMMON
2016-04-19 Adam Sieradzanmodyfication for tube
2016-03-30 Adam Sieradzanwham is prining energies; all "good" changes seems...
2016-03-08 Adam Sieradzanbug fix after Ana and cluster lipid (still in progress)
2016-02-11 Adam Sieradzanworking cluser DEBUG OFF
2016-02-11 Adam Sieradzanintroduction of shielding to cluster DEBUG mode
2016-02-04 Adam SieradzanBUG FIX in arcos.f
2016-02-03 Adam Sieradzancorrection in wham and UNRES for lipid and correlation
2016-01-12 Adam Sieradzanadding common shield
2016-01-12 Adam Sieradzanchanges in wham
2015-10-29 Adam Sieradzancorrection in readrefstr
2015-09-29 Adam SieradzanMerge branch 'lipid' into AFM
2015-09-29 Adam SieradzanESSENTIAL CHANGE - BUG FIX in ENERGY to have old Correl...
2015-09-29 Adam Sieradzanwham in lipid still diff
2015-08-06 Adam SieradzanMerge branch 'devel' into AFM
2015-08-03 Adam Sieradzan1) debug of Lorentzian like constrains in cluster 2...
2015-08-02 Adam Sieradzanfirst introduction of valence constrains - not working yet
2015-07-31 Adam Sieradzanintroduction of different ftors for each site
2015-07-28 Adam SieradzanIntoduction Lorentizan like restrains to cluster
2015-07-21 Adam SieradzanWHAM for Lorentzian like constrains fixed - DEBUG OFF
2015-07-20 Adam Sieradzandebuging WHAM for constrains DEBUG ON
2015-07-10 Adam Sieradzanintroduction of quartic an Lonrentz constrains to WHAM
2015-05-25 Adam Sieradzanhidden part of debug
2015-05-25 Adam Sieradzannss*ebr removed
2015-05-25 Adam Sieradzancxread debug 7
2015-05-25 Adam Sieradzandebug part 6
2015-05-25 Adam SieradzanDebug 5
2015-05-25 Adam Sieradzananother DEBUG
2015-05-25 Adam Sieradzandubug dss part 3
2015-05-25 Adam Sieradzandiffrent name for evdw
2015-05-25 Adam SieradzanTRISS debug
2015-05-25 Adam SieradzanWarnig Debug ON
2015-05-24 Adam SieradzanCorrected WHAM and UNRES reading in SS dyn...
2015-05-23 Adam SieradzanIntroduction of working dyn_ss and triss. Problems...
2015-05-23 Adam SieradzanCorrection in readrtns
2015-05-23 Adam SieradzanChange in line of dyn_ss
2015-05-22 Adam SieradzanAdding dyn_ss and triss potentials to src-M wham
2015-05-06 Dawid Jagielafixed install binary paths
2015-04-21 Pawel KrupaMPICH2 and energy fixes in WHAM-M and Cluster-M.
2015-04-17 Pawel KrupaFixed error caused by new MPICH2, which made WHAM-M...
2015-04-16 Pawel KrupaFixed energy differs in WHAM-M (EBE).
2015-04-05 Dawid Jagielaadded Force-Fields descriptions in exe filenames
2014-12-17 Adam SieradzanMerge branch 'master' of mmka:unres
2014-12-17 Adam SieradzanMerge branch 'master' of mmka:unres into multichain
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 JagielaMerge branch 'prerelease-3.2.1' into devel
2014-10-27 Dawid Jagiela1) binaries are compiled into /bin subdirectory of...
2014-10-26 Dawid Jagielaswitched to CMake FindMPI module in all source files...
2014-10-26 Dawid Jagielaswitched to CMake FindMPI module in all source files...
2014-10-08 Cezary Czaplewskicorrect default option for compilers in wham CmakeList.txt
2014-09-11 Adam Kazimierz Sie... poprawka w triss
2014-06-10 Adam SieradzanIntroduction of PBC to cluster energy and reading,...
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
2013-11-05 Adam SieradzanDebug part 2
2013-11-05 Adam Sieradzanpierwsza proba merga devela do adasko
2013-11-05 Adam SieradzanDostosowanie w src whama i clustra
2013-04-12 Dawid Jagielaadded default preprocessor flags for unknown compilers
2013-04-12 Dawid Jagielaadded default preprocessor flags for unknown compilers
2013-02-16 Cezary Czaplewskicommon sccor rename to avoid conflict with torsion
2013-02-16 Cezary Czaplewskicommon sccor rename to avoid conflict with torsion
2013-01-10 Dawid Jagielafixed missing closing bracket
2013-01-10 Dawid Jagielafixed missing closing bracket
2013-01-10 Dawid JagielaWHAM -DISNAN fix
2013-01-10 Dawid JagielaWHAM -DISNAN fix
2013-01-10 Dawid Jagielaadded UNRES_MD_FF setting for WHAM in (wham & cluster...
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
2012-12-18 Adam SieradzanUsuniecie diagnostyki
2012-12-10 Adam Sieradzanzmiana w COMMONIE
2012-12-06 Adam Sieradzanbugfix w whamie w parmreadzie
2012-12-06 Adam Sieradzanbugfix przekroczenia granic
2012-12-05 Adam Sieradzanzmaina w xdrf
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)
2012-11-23 Dawid Jagielagfortran fixes in local_move.f, energy_p_new.F & initia...
2012-11-23 Dawid Jagielagfortran fixes in local_move.f, energy_p_new.F & initia...
2012-11-23 Dawid Jagielaforce legacy standard for gfortran
2012-11-23 Dawid Jagielaforce legacy standard for gfortran
2012-11-07 Dawid Jagielaforce legacy standard for gfortran
2012-11-07 Dawid Jagielaforce legacy standard for gfortran
2012-10-31 Dawid JagielaCMake makro cinfo.f fix
2012-10-31 Dawid JagielaCMake makro cinfo.f fix
2012-10-30 Adam Kazimierz Sie... Wstawnieni SCCOR dla clustrowania. Nie wiadomo czy...
2012-10-29 Adam Kazimierz Sie... Wprowadzenie SCCOR dla wham-M
2012-10-26 Adam Kazimierz Sie... Rozgrzebany SCCOR dla wham-M
2012-08-31 Adam Kazimierz Sie... Zmina 21 na ntyp1 w wham src i src-M
2012-08-24 Adam Kazimierz Sie... Dzialajaczy dla D aminokwasow whama(mono) psuedosymetri...
2012-08-20 Dawid Jagiela1. cmake cinfo.f generation for all sources 2. deleted...
2012-08-20 Dawid Jagiela1. cmake cinfo.f generation for all sources 2. deleted...
2012-08-17 Adam Kazimierz Sie... Wham po zmianach i dzialajac dla D aminokwasow i BEZ...
2012-07-19 Dawid Jagielacinfo.f generation and macro for unres MD
2012-07-19 Dawid Jagielacinfo.f generation and macro for unres MD
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