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unres.git
2013-02-17
Cezary Czaplewski
dyn_ss writing pdb and ihpb cleaning
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2013-02-16
Cezary Czaplewski
more type cleaning in DFA
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2013-02-16
Cezary Czaplewski
type declaration in COMMON.DFA
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2013-02-16
Cezary Czaplewski
no type declaration in common
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2013-02-16
Cezary Czaplewski
no type declaration in common
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2013-02-16
Cezary Czaplewski
common sccor rename to avoid conflict with torsion
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2013-02-16
Cezary Czaplewski
classical Makefile cleaning
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2013-02-16
Cezary Czaplewski
rename common sccorin src_CSA
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2013-02-16
Cezary Czaplewski
src_MD-M compiles with old Makefile and common sccor...
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2013-02-16
Cezary Czaplewski
common name correction
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2013-02-16
Cezary Czaplewski
prng and not prng_32 for gfortran
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2013-02-16
Cezary Czaplewski
prng and not prng_32 for f95
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2013-02-16
Cezary Czaplewski
new SCCORPAR for ctest
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2013-02-16
Cezary Czaplewski
common reorder to avoid padding in gfortran
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2013-02-15
Cezary Czaplewski
dynamic disulfides are working again in md
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2013-02-15
Cezary Czaplewski
adding ename to statout with PRINT_COMPON
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2013-02-15
Cezary Czaplewski
MULTCONF is working now
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2013-02-15
Cezary Czaplewski
error message when reading SCCOR corrected
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2013-02-15
Cezary Czaplewski
ss_dyn compiles with make and with cmake
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2013-02-15
Cezary Czaplewski
dynamic SS from old Maurizio's code
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2013-02-14
Cezary Czaplewski
compilation only
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2013-01-10
Dawid Jagiela
fixed missing closing bracket
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2013-01-10
Dawid Jagiela
WHAM -DISNAN fix
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2013-01-10
Dawid Jagiela
added UNRES_MD_FF setting for WHAM in (wham & cluster...
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2012-12-19
Dawid Jagiela
Merge branch 'prerelease-3.2.1' of mmka:unres into...
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2012-12-19
Dawid Jagiela
poprawki w COMMONAch
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2012-12-04
Pawel Krupa
New examples based on current version of UNRES.
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2012-11-23
Dawid Jagiela
gfortran fixes in local_move.f, energy_p_new.F & initia...
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2012-11-23
Dawid Jagiela
gfortran foxes in src_CSA/energy_p_new_barrier.F, src_C...
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2012-11-23
Dawid Jagiela
fixed typos in initialize_p.F
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2012-11-23
Dawid Jagiela
gfortran fixes in src_CSA for initialize_p.F
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2012-11-23
Dawid Jagiela
gfortran fixes for src_MD-M
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2012-11-23
Dawid Jagiela
fix 80 column in initialize_p.F
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2012-11-23
Dawid Jagiela
gfortran fixes in initialize_p.F for src_MD-M
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2012-11-23
Dawid Jagiela
alignment fixes in COMMON.CHAIN for src_MD-M
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2012-11-23
Dawid Jagiela
gfortran fixes in initialize_p.F for MPI
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2012-11-23
Dawid Jagiela
some gfortran warning fixes
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2012-11-23
Dawid Jagiela
force legacy standard for gfortran
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2012-11-23
Dawid Jagiela
gfortran legacy standard enforcement
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2012-11-05
Dawid Jagiela
alignment fix in src_MD COMMON.SCCOR
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2012-11-05
Dawid Jagiela
alignment fixes in src_MD COMMONs
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2012-10-31
Dawid Jagiela
fix tcpu function in cluster/wham for gfortran
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2012-10-31
Dawid Jagiela
Merge branch 'devel' of mmka:unres into devel
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2012-10-31
Dawid Jagiela
tcpu function fix for gfortran
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2012-10-31
Dawid Jagiela
CMake makro cinfo.f fix
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2012-10-31
Dawid Jagiela
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
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2012-10-30
Dawid Jagiela
CMake unres/src_MIN missing sources fix
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2012-10-24
Pawel Krupa
New microcanonical examples.
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2012-10-17
Adam Kazimierz...
Poprawka w Cmakelist
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2012-10-17
Adam Liwo
10/17/2012 by Adam: Implemented sideadd correction...
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2012-10-17
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
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2012-10-17
Adam Liwo
Merge branch 'adam' into devel
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2012-10-17
Adam Liwo
Commit 10/17/12 Adam
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2012-10-07
Dawid Jagiela
removed CMake cache files from source - breaks CDash...
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2012-10-06
Bartlomiej...
CMakeFiles
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2012-10-06
Bartlomiej...
Small changes in source src_CSA_DiL. Compilation works now
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2012-10-03
Bartlomiej...
Fixed Cmake variable
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2012-10-03
Bartlomiej...
1. Fixed merge conflicts
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2012-10-02
Bartlomiej...
Merge branch 'bartek' into devel
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2012-10-02
Bartlomiej...
Merge branch 'bartek2' into bartek
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2012-10-02
Bartlomiej...
zmiana do DiL
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2012-10-02
Bartlomiej...
Rozgrzebany DIL
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2012-10-02
Bartlomiej...
Merge branch 'bartek' of mmka:unres into bartek
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2012-10-02
Bartlomiej...
D i L aminokwasy dzialajace dla src_CSA
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2012-10-01
Adam Liwo
Commit 10/1/12
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2012-09-26
Bartlomiej...
Merge branch 'bartek' of mmka:unres into bartek
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2012-09-26
Bartlomiej...
"DiL zmiana w param read i tuz przed testami"
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2012-09-26
Bartlomiej...
"Przygotowanie CSA do D i L aminokwasow"
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2012-09-26
Pawel Krupa
New microcanonical examples.
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2012-09-20
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
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2012-09-20
Adam Liwo
Update
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2012-09-20
Adam Liwo
Sept 20/2012 by Adam: commit changes mostly in the...
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2012-09-20
Dawid Jagieła
deleted: test.txt
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2012-09-20
Dawid Jagiela
Merge branch 'devel' of mmka:unres into devel
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2012-09-20
Dawid Jagiela
fix broken gitweb
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2012-09-20
Cezary Czaplewski
Merge branch 'master' of mmka:unres into devel
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2012-08-24
Pawel Krupa
Dodanie przykladow do MD, REMD, MREMD i mikrokanonicznego
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2012-08-20
Dawid Jagiela
added CMake build file for source/maxlik/src_CSA/
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2012-08-20
Dawid Jagiela
1. cmake cinfo.f generation for all sources 2. deleted...
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2012-08-08
Bartlomiej...
Maximum likelihood parameters optimization program...
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2012-08-08
Bartlomiej...
New examples for GAB force fields (restrained, unrestra...
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2012-08-08
Bartlomiej...
CASP3 force field deleted. Fixed merge conflicts.
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2012-08-08
Bartlomiej...
Old force fields removed, new ones (GAB, E0LL2Y) added.
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2012-07-31
Adam Kazimierz...
poprawka clustrowania z potencjalami wsccor (zle czytan...
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2012-07-30
Adam Kazimierz...
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
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2012-07-30
Adam Kazimierz...
poprawka w cluster dla potencjalow shelleya
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2012-07-19
Dawid Jagiela
Merge branch 'devel' of mmka:unres into devel
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2012-07-19
Dawid Jagiela
cinfo.f generation and macro for unres MD
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2012-07-18
Adam Liwo
Merge branch 'devel' into adam
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2012-07-18
Adam Liwo
cinfo
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2012-07-18
Adam Kazimierz...
modified Makefile
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2012-07-18
Adam Kazimierz...
hotfix parmread
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2012-07-18
Adam Liwo
Implement minor changes on branch adam
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2012-07-18
Adam Kazimierz...
Revert "Merge branch 'adasko' into devel"
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2012-07-18
Adam Kazimierz...
Revert "poprawka przy liczeniu tau w clustrze"
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2012-07-17
Adam Kazimierz...
Merge branch 'adasko' into devel
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2012-07-17
Adam Kazimierz...
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
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2012-07-17
Adam Kazimierz...
D i L aminokwasy dzialajace dla src_MD
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2012-07-09
Adam Kazimierz...
D i L aminokwasy tuz przed testami
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2012-07-06
Dawid Jagiela
Merge branch 'devel' of mmka:unres into devel
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