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[unres.git] / source / unres /
2020-03-22 Cezary Czaplewskictest dfa tree | commitdiff
2020-03-20 Cezary Czaplewskictest NEWCORR tree | commitdiff
2020-03-20 Cezary Czaplewskictest csa - commented tree | commitdiff
2020-03-20 Cezary Czaplewskictest dock wham and old source rm tree | commitdiff
2020-03-19 Cezary Czaplewskicmake NEWCORR tree | commitdiff
2020-03-19 Cezary Czaplewskirm JESTEM printout tree | commitdiff
2020-03-19 Cezary Czaplewskictest UNRES_M_MD_microcanonical tree | commitdiff
2020-03-19 Cezary Czaplewskictest plot UNRES_M_MD_microcanonical tree | commitdiff
2020-03-18 Cezary Czaplewskienergy_dec print_compon tree | commitdiff
2020-03-16 Cezary Czaplewskigfortran geomout.F:(.text+0x48df): relocation truncated... tree | commitdiff
2020-03-15 Cezary Czaplewskigfortran geomout.F:(.text+0x48df): relocation truncated... tree | commitdiff
2020-03-15 Cezary Czaplewskiisnan logical isnan(potEcomp(0)).gt.0 tree | commitdiff
2020-03-15 Cezary Czaplewskictest csa grep -v GenSide tree | commitdiff
2020-03-15 Cezary Czaplewskictest csa tree | commitdiff
2020-03-15 Cezary Czaplewskictest unres tree | commitdiff
2020-03-14 Cezary Czaplewskicleaning and csa update tree | commitdiff
2015-10-26 Pawel KrupaOptimization of the solution for the disulfide problem. tree | commitdiff
2015-10-21 Adam Sieradzantrial for X-Cys-Cys-X sequences tree | commitdiff
2015-10-21 Adam Sieradzanwham debug off and bug fix for dtriss =0 tree | commitdiff
2015-09-22 Adam Sieradzandebug in respa tree | commitdiff
2015-08-03 Adam Sieradzan1) debug of Lorentzian like constrains in cluster 2... tree | commitdiff
2015-08-02 Adam Sieradzanfirst introduction of valence constrains - not working yet tree | commitdiff
2015-07-31 Adam Sieradzanintroduction of different ftors for each site tree | commitdiff
2015-07-28 Adam SieradzanIntoduction Lorentizan like restrains to cluster tree | commitdiff
2015-07-21 Adam SieradzanWHAM for Lorentzian like constrains fixed - DEBUG OFF tree | commitdiff
2015-07-06 Adam Sieradzanintoduction of quartic restrains in multichain, bugfix... tree | commitdiff
2015-07-03 Adam SieradzanWeFold Lorentzian like potentials introduction tree | commitdiff
2015-06-24 Dawid Jagielaremoved uninitialized ghalf from equation tree | commitdiff
2015-05-26 Dawid Jagielaremoved obsolite code in ssMD.F files tree | commitdiff
2015-05-25 Adam SieradzanTRISS debug tree | commitdiff
2015-05-25 Adam SieradzanWarnig Debug ON tree | commitdiff
2015-05-24 Adam SieradzanCorrected WHAM and UNRES reading in SS dyn... tree | commitdiff
2015-05-22 Pawel KrupaMerge branch 'devel' of mmka.chem.univ.gda.pl:unres... tree | commitdiff
2015-05-22 Pawel KrupaFixed bug in reading trisulfide potentials (atriss... tree | commitdiff
2015-05-06 Dawid Jagielafixed install binary paths tree | commitdiff
2015-04-21 Pawel KrupaMPICH2 and energy fixes in WHAM-M and Cluster-M. tree | commitdiff
2015-04-17 Adam Sieradzanpoprawka w COMMON.SBRIDE dla triss tree | commitdiff
2015-04-13 Adam Sieradzanpoprawka w intcartderiv tree | commitdiff
2015-04-13 Adam SieradzanIntroduction of SS to newcorr and SSS to src_MD-M tree | commitdiff
2015-03-26 Pawel KrupaMD problems fixed with FGPROC>1 tree | commitdiff
2015-02-19 Adam Sieradzanpoprawki w ANG w src_MD-M tree | commitdiff
2015-01-29 Adam LiwoCorrected refsys.f in src_MD-M tree | commitdiff
2014-12-05 Cezary Czaplewskichanges from prerelease src_CSA_DiL copied to devel tree | commitdiff
2014-11-06 Dawid Jagielafixed src_MD_DFA ala10 ctest tree | commitdiff
2014-11-06 Dawid Jagiela1) changes for FindMPI macro in source/unres/src_MD_DFA tree | commitdiff
2014-11-05 Dawid Jagielafixed marge problem tree | commitdiff
2014-11-05 Dawid JagielaMerge branch 'prerelease-3.2.1' into devel tree | commitdiff
2014-11-05 Dawid Jagielactest ala10 binary location fix tree | commitdiff
2014-10-27 Dawid Jagiela1) binaries are compiled into /bin subdirectory of... tree | commitdiff
2014-10-26 Dawid Jagiela1) Threading cleanup in src_CSA & src_CSA_DiL tree | commitdiff
2014-10-26 Dawid Jagielaswitched to CMake FindMPI module in all source files... tree | commitdiff
2014-10-26 Dawid Jagielaswitched to CMake FindMPI module in all source files... tree | commitdiff
2014-10-26 Dawid Jagielaadded missing preprocessor flags for prng_32.F tree | commitdiff
2014-10-25 Dawid Jagielaprng.f unification tree | commitdiff
2014-10-16 Dawid Jagiela64-bit fix for unres/CSA and unres/CSA_DiL code tree | commitdiff
2014-10-14 Dawid Jagiełafixed CMake variable typo tree | commitdiff
2014-07-23 Dawid Jagielaadded "make install" support for: unres (MD, MD-M,... tree | commitdiff
2014-07-04 Adam Kazimierz Sie... BUG FIX for SUMSL minimization tree | commitdiff
2014-06-24 Adam SieradzanMerge branch 'devel' of mmka:unres into devel tree | commitdiff
2014-06-24 Adam Sieradzanbug fix for langevin dynamics tree | commitdiff
2014-06-24 Cezary CzaplewskiMakefile without debuging tree | commitdiff
2014-06-18 Cezary CzaplewskiMerge branch 'devel' of mmka:unres into devel tree | commitdiff
2014-06-18 Cezary Czaplewskidyn-ss in MD-M tree | commitdiff
2014-06-17 Adam Kazimierz Sie... dalej wylaczona diagnostyka tree | commitdiff
2014-06-17 Adam Kazimierz Sie... wylacznie diagnostyki tree | commitdiff
2014-06-17 Cezary Czaplewskicorrecter Makefile and errors side chain parameters tree | commitdiff
2014-06-03 Dawid Jagiełafixed typo tree | commitdiff
2014-06-03 Dawid Jagiełafix for MD tests in E0LL2Y FF tree | commitdiff
2014-06-03 Dawid Jagiełafixed binary name generation in unres/src_MD-M tree | commitdiff
2014-06-03 Dawid JagiełaMerge branch 'devel' of mmka:unres into devel tree | commitdiff
2014-06-03 Dawid Jagieławywalka smieci - ludzie budujcie w katalogu build! tree | commitdiff
2014-06-03 Bartlomiej ZaborowskiMerge branch 'devel' of mmka:unres into devel tree | commitdiff
2014-06-03 Bartlomiej ZaborowskiModification files required corresponding architecture tree | commitdiff
2014-06-03 Bartlomiej ZaborowskiModification files required corresponding architecture tree | commitdiff
2014-05-08 Adam Sieradzanwlaczenie timing tree | commitdiff
2014-05-08 Adam SieradzanMerge branch 'devel' of mmka:unres into devel tree | commitdiff
2014-04-10 Adam LiwoMerge branch 'devel' of mmka.chem.univ.gda.pl:unres... tree | commitdiff
2014-04-10 Adam LiwoAdded src_MD-M-newcorr (Adasko's source) and src-NEWSC... tree | commitdiff
2014-04-01 Adam LiwoAdded src_Eshel (decoy processing for threading) tree | commitdiff
2014-03-19 Adam LiwoFixed iatsc_s and iatscp_s for 1 residue (was 0 with... tree | commitdiff
2014-03-18 Adam SieradzanDevel ma zle COMMON.TORSIONAL w src_MD (single chain) tree | commitdiff
2013-11-06 Dawid Jagielajunk files cleanup tree | commitdiff
2013-11-05 Adam SieradzanDebug part 6 tree | commitdiff
2013-11-05 Adam SieradzanDebug part 5 tree | commitdiff
2013-11-05 Adam SieradzanDebug part 4 tree | commitdiff
2013-11-05 Adam SieradzanDebug part 3 tree | commitdiff
2013-11-05 Adam SieradzanDebug part 2 tree | commitdiff
2013-11-05 Adam SieradzanDebug part 1 tree | commitdiff
2013-11-05 Adam SieradzanMerge branch 'adasko' into devel tree | commitdiff
2013-11-05 Adam Sieradzanpierwsza proba merga devela do adasko tree | commitdiff
2013-10-30 Cezary CzaplewskiMakefile for pgi 2013 tree | commitdiff
2013-10-30 Cezary Czaplewskitesting Makefile for pgi compiler tree | commitdiff
2013-09-02 Dawid Jagielaresolved conflicts in: source/unres/src_MD/CMakeLists.txt tree | commitdiff
2013-09-02 Cezary Czaplewskirepair of broken merge tree | commitdiff
2013-09-02 Cezary CzaplewskiMerge branch 'devel' of mmka:unres into devel tree | commitdiff
2013-09-02 Cezary Czaplewskimerging devel tree | commitdiff
2013-09-02 Cezary CzaplewskiMerge branch 'prerelease-3.2.1' of mmka:unres into... tree | commitdiff
2013-09-02 Cezary Czaplewskidynamic disulfides in multichain tree | commitdiff
2013-08-31 Adam Kazimierz Sie... 1)Clean-up 2)making similar src_MD and its multichain... tree | commitdiff
2013-08-31 Adam Kazimierz Sie... Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres... tree | commitdiff
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