unres.git
2020-03-19 Cezary Czaplewskictest ref ene
2020-03-19 Cezary Czaplewskicorrect theta_abinitio_old_ext.parm
2020-03-19 Cezary Czaplewskictest UNRES_M_ss_static_min
2020-03-19 Cezary Czaplewskirm JESTEM printout
2020-03-19 Cezary Czaplewskictest UNRES_M_MD_microcanonical ene tol 6.0
2020-03-19 Cezary Czaplewskictest UNRES_M_REGULAR
2020-03-19 Cezary Czaplewskictest UNRES_M_MD_microcanonical
2020-03-19 Cezary Czaplewskictest plot UNRES_M_MD_microcanonical
2020-03-19 Cezary Czaplewskictest ref ene min
2020-03-18 Cezary Czaplewskictest update ene ref
2020-03-18 Cezary Czaplewskienergy_dec print_compon
2020-03-17 Cezary Czaplewskictest dock cluster
2020-03-17 Cezary Czaplewskisco format read2sigma wham cluster_wham
2020-03-17 Cezary Czaplewskictest dock read_minim_par
2020-03-17 Cezary Czaplewskictest dock chmod 2
2020-03-17 Cezary Czaplewskictest dock chmod
2020-03-17 Cezary Czaplewskictest python2
2020-03-16 Cezary Czaplewskigfortran geomout.F:(.text+0x48df): relocation truncated...
2020-03-15 Cezary Czaplewskigfortran geomout.F:(.text+0x48df): relocation truncated...
2020-03-15 Cezary Czaplewskiisnan logical isnan(potEcomp(0)).gt.0
2020-03-15 Cezary Czaplewskictest csa grep -v GenSide
2020-03-15 Cezary Czaplewskictest csa
2020-03-15 Cezary Czaplewskictest unres
2020-03-15 Cezary Czaplewskictest wham
2020-03-15 Cezary Czaplewskictest wham
2020-03-14 Cezary Czaplewskicleaning ln xdrf
2020-03-14 Cezary Czaplewskictest cluster wham dfa
2020-03-14 Cezary Czaplewskictest cluster wham
2020-03-14 Cezary Czaplewskictest xdrf2pdb
2020-03-14 Cezary Czaplewskicluster unres
2020-03-14 Cezary Czaplewskicleaning and csa update
2020-03-14 Cezary Czaplewskirm exe
2016-03-10 Pawel KrupaCalculation of folded fractions (at given RMSD cutoff...
2015-10-26 Pawel KrupaOptimization of the solution for the disulfide problem.
2015-10-21 Adam Sieradzantrial for X-Cys-Cys-X sequences
2015-10-21 Adam Sieradzanwham debug off and bug fix for dtriss =0
2015-10-21 Adam Sieradzanwham debug on
2015-09-22 Adam Sieradzandebug in respa
2015-09-03 Adam Sieradzanbug fix in WHAM for disulfides
2015-08-03 Adam Sieradzanadding of sccor am1 parameter file
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
2015-07-06 Adam Sieradzanintoduction of quartic restrains in multichain, bugfix...
2015-07-03 Adam SieradzanWeFold Lorentzian like potentials introduction
2015-06-24 Dawid JagielaMerge branch 'devel' of mmka.chem.univ.gda.pl:unres...
2015-06-24 Dawid Jagielaremoved uninitialized ghalf from equation
2015-05-27 Adam Sieradzanworking cluster for dyn_ss and triss
2015-05-26 Adam SieradzanDebug cluster part 2
2015-05-26 Adam SieradzanCluster debug ON
2015-05-26 Adam Sieradzanhavebond turnoff
2015-05-26 Adam Sieradzan correction of readrtns
2015-05-26 Adam SieradzanMerge branch 'devel' of mmka:unres into devel
2015-05-26 Adam Sieradzanenergy_dec to logical
2015-05-26 Dawid Jagielaremoved obsolite code in ssMD.F files
2015-05-26 Adam SieradzanIntroduction of dyn_ss and triss to cluster
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 SieradzanMerge branch 'devel' of mmka:unres into devel
2015-05-22 Adam SieradzanAdding dyn_ss and triss potentials to src-M wham
2015-05-22 Pawel KrupaMerge branch 'devel' of mmka.chem.univ.gda.pl:unres...
2015-05-22 Pawel KrupaFixed bug in reading trisulfide potentials (atriss...
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 Adam SieradzanMerge branch 'devel' of mmka:unres into devel
2015-04-17 Pawel KrupaFixed error caused by new MPICH2, which made WHAM-M...
2015-04-17 Adam Sieradzanpoprawka w COMMON.SBRIDE dla triss
2015-04-16 Pawel KrupaFixed energy differs in WHAM-M (EBE).
2015-04-13 Adam Sieradzanpoprawka w intcartderiv
2015-04-13 Adam SieradzanIntroduction of SS to newcorr and SSS to src_MD-M
2015-04-05 Dawid JagielaMerge branch 'devel' of mmka:unres into devel
2015-04-05 Dawid Jagielaadded Force-Fields descriptions in exe filenames
2015-03-26 Pawel KrupaMD problems fixed with FGPROC>1
2015-02-19 Adam Sieradzanpoprawki w ANG w src_MD-M
2015-01-29 Adam LiwoCorrected refsys.f in src_MD-M
2014-12-05 Cezary Czaplewskichanges from prerelease src_CSA_DiL copied to devel
2014-11-06 Dawid Jagielafixed src_MD_DFA ala10 ctest
2014-11-06 Dawid Jagiela1) changes for FindMPI macro in source/unres/src_MD_DFA
2014-11-05 Dawid Jagielafixed marge problem
2014-11-05 Dawid JagielaMerge branch 'prerelease-3.2.1' into devel
2014-11-05 Dawid JagielaMerge branch 'prerelease-3.2.1' of mmka:unres into...
2014-11-05 Dawid Jagielactest ala10 binary location fix
2014-11-05 Dawid JagiełaAdded CMake build instructions
2014-10-31 Dawid Jagielafix for multiple MPI include paths passed by MPI wrapper
next