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small changes to compile in gfortran
[unres.git]
/
source
/
2013-02-16
Cezary Czaplewski
small changes to compile in gfortran
tree
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commitdiff
2013-02-10
Dawid Jagiela
added UNRES visualization plugin for PyMOL
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commitdiff
2013-02-07
Bartlomiej Zaborowski
kosmetyczne zmiany do MD_DFA
tree
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commitdiff
2013-02-06
Bartlomiej Zaborowski
Merge branch 'devel' of mmka:unres into devel
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commitdiff
2013-02-06
Bartlomiej Zaborowski
Files to working MD_DFA
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commitdiff
2013-02-06
Dawid Jagiela
added pymol/UNRESInpGen.py - generates inputs for MD
tree
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commitdiff
2012-11-23
Dawid Jagiela
alignment fixes in COMMON.CHAIN for src_MD-M
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commitdiff
2012-11-23
Dawid Jagiela
some gfortran warning fixes
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commitdiff
2012-11-08
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
tree
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commitdiff
2012-11-08
Adam Liwo
8/11/12 by Adam: fixed disulfide bridge problems
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commitdiff
2012-11-07
Dawid Jagiela
force legacy standard for gfortran
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commitdiff
2012-11-07
Dawid Jagiela
gfortran legacy standard enforcement
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commitdiff
2012-11-05
Dawid Jagiela
alignment fix in src_MD COMMON.SCCOR
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commitdiff
2012-11-05
Dawid Jagiela
alignment fixes in src_MD COMMONs
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commitdiff
2012-10-31
Dawid Jagiela
fix tcpu function in cluster/wham for gfortran
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commitdiff
2012-10-31
Dawid Jagiela
Merge branch 'devel' of mmka:unres into devel
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commitdiff
2012-10-31
Dawid Jagiela
tcpu function fix for gfortran
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commitdiff
2012-10-31
Dawid Jagiela
CMake makro cinfo.f fix
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commitdiff
2012-10-30
Dawid Jagiela
CMake unres/src_MIN missing sources fix
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commitdiff
2012-10-17
Adam Kazimierz Sie...
Poprawka w Cmakelist
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commitdiff
2012-10-17
Adam Liwo
10/17/2012 by Adam: Implemented sideadd correction...
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commitdiff
2012-10-17
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
tree
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commitdiff
2012-10-17
Adam Liwo
Merge branch 'adam' into devel
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commitdiff
2012-10-17
Adam Liwo
Commit 10/17/12 Adam
tree
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commitdiff
2012-10-06
Bartlomiej Zaborowski
Small changes in source src_CSA_DiL. Compilation works now
tree
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commitdiff
2012-10-03
Bartlomiej Zaborowski
Fixed Cmake variable
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commitdiff
2012-10-03
Bartlomiej Zaborowski
1. Fixed merge conflicts
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commitdiff
2012-10-02
Bartlomiej Zaborowski
Merge branch 'bartek' into devel
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commitdiff
2012-10-02
Bartlomiej Zaborowski
Merge branch 'bartek2' into bartek
tree
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commitdiff
2012-10-02
Bartlomiej Zaborowski
zmiana do DiL
tree
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commitdiff
2012-10-02
Bartlomiej Zaborowski
Rozgrzebany DIL
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commitdiff
2012-10-02
Bartlomiej Zaborowski
D i L aminokwasy dzialajace dla src_CSA
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commitdiff
2012-10-01
Adam Liwo
Commit 10/1/12
tree
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commitdiff
2012-09-26
Bartlomiej Zaborowski
"DiL zmiana w param read i tuz przed testami"
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commitdiff
2012-09-26
Bartlomiej Zaborowski
"Przygotowanie CSA do D i L aminokwasow"
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commitdiff
2012-09-20
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
tree
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commitdiff
2012-09-20
Adam Liwo
Update
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commitdiff
2012-09-20
Adam Liwo
Sept 20/2012 by Adam: commit changes mostly in the...
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commitdiff
2012-08-20
Dawid Jagiela
added CMake build file for source/maxlik/src_CSA/
tree
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commitdiff
2012-08-20
Dawid Jagiela
1. cmake cinfo.f generation for all sources 2. deleted...
tree
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commitdiff
2012-08-08
Bartlomiej Zaborowski
Maximum likelihood parameters optimization program...
tree
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commitdiff
2012-08-08
Bartlomiej Zaborowski
CASP3 force field deleted. Fixed merge conflicts.
tree
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commitdiff
2012-08-08
Bartlomiej Zaborowski
Old force fields removed, new ones (GAB, E0LL2Y) added.
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commitdiff
2012-07-31
Adam Kazimierz Sie...
poprawka clustrowania z potencjalami wsccor (zle czytan...
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commitdiff
2012-07-30
Adam Kazimierz Sie...
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
tree
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commitdiff
2012-07-30
Adam Kazimierz Sie...
poprawka w cluster dla potencjalow shelleya
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commitdiff
2012-07-19
Dawid Jagiela
Merge branch 'devel' of mmka:unres into devel
tree
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commitdiff
2012-07-19
Dawid Jagiela
cinfo.f generation and macro for unres MD
tree
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commitdiff
2012-07-18
Adam Liwo
Merge branch 'devel' into adam
tree
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commitdiff
2012-07-18
Adam Liwo
cinfo
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commitdiff
2012-07-18
Adam Kazimierz Sie...
modified Makefile
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commitdiff
2012-07-18
Adam Kazimierz Sie...
hotfix parmread
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commitdiff
2012-07-18
Adam Liwo
Implement minor changes on branch adam
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commitdiff
2012-07-18
Adam Kazimierz Sie...
Revert "Merge branch 'adasko' into devel"
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commitdiff
2012-07-18
Adam Kazimierz Sie...
Revert "poprawka przy liczeniu tau w clustrze"
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commitdiff
2012-07-17
Adam Kazimierz Sie...
Merge branch 'adasko' into devel
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commitdiff
2012-07-17
Adam Kazimierz Sie...
D i L aminokwasy dzialajace dla src_MD
tree
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commitdiff
2012-07-09
Adam Kazimierz Sie...
D i L aminokwasy tuz przed testami
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commitdiff
2012-07-06
Adam Kazimierz Sie...
poprawki makefile ktore i tak zostan zmienione
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commitdiff
2012-07-06
Adam Kazimierz Sie...
wyrowanie COMMON>SCCOR
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commitdiff
2012-07-06
Adam Kazimierz Sie...
Wyrowanie w COmmonie...
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commitdiff
2012-07-06
Adam Kazimierz Sie...
poprawka przy liczeniu tau w clustrze
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commitdiff
2012-07-06
Adam Kazimierz Sie...
proba pullowania
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commitdiff
2012-07-06
Adam Kazimierz Sie...
Zabijanie robakow znalezionych przez Pawla w WHAMie
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commitdiff
2012-07-06
Adam Kazimierz Sie...
zmiana do DiL
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commitdiff
2012-07-05
Adam Liwo
Merge branch 'adam' into devel
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commitdiff
2012-07-05
Adam Liwo
Minor change
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commitdiff
2012-07-05
Adam Liwo
Minor change
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commitdiff
2012-07-05
Adam Kazimierz Sie...
zmiana binarki...
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commitdiff
2012-07-05
Adam Liwo
Merge branch 'adam' into devel
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commitdiff
2012-07-05
Adam Liwo
5/7/2012 by Adam
tree
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commitdiff
2012-07-05
Adam Kazimierz Sie...
DIL zmiana w param read
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commitdiff
2012-07-05
Adam Kazimierz Sie...
hotfix of SCCOR potentials
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commitdiff
2012-07-05
Adam Kazimierz Sie...
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
tree
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commitdiff
2012-07-05
Adam Kazimierz Sie...
hotfix do potencjalow AM1
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commitdiff
2012-07-05
Adam Kazimierz Sie...
Rozgrzebany DIL
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commitdiff
2012-06-27
Dawid Jagiela
1) added ctests for xdrf2pdb-m 2) cleanup
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commitdiff
2012-06-27
Dawid Jagiela
fixed broken (by adasko) alignment in COMMON.SCCOR
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commitdiff
2012-06-27
Adam Kazimierz Sie...
Merge branch 'adasko' into devel
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commitdiff
2012-06-27
Adam Kazimierz Sie...
glupia zmiana
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commitdiff
2012-06-27
Adam Kazimierz Sie...
Wprowadzenie SCCOR do WHAMa i CLUSTROWNIA
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commitdiff
2012-06-20
Dawid Jagiela
LAM/MPI boot ctest modification
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commitdiff
2012-06-19
Dawid Jagiela
added -cpp flag to force preprocesing for all files...
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commitdiff
2012-06-19
Dawid Jagiela
Moved ifdef MOMENT part from COMMON.CONTACTS to COMMON...
tree
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commitdiff
2012-06-18
Dawid Jagiela
enable compiler preprocesor flags for non-standard...
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commitdiff
2012-06-18
Dawid Jagiela
added source/cluster/wham/src/gnmr1.f to cmake build
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commitdiff
2012-06-18
Dawid Jagiela
added gnmr1.f to sources in cmake builds
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commitdiff
2012-06-18
Dawid Jagiela
fixed merge conflict in readrtns_csa.F
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commitdiff
2012-06-18
Dawid Jagiela
fixed source/xdrfpdb/src-M/xdrf2pdb-m.F
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commitdiff
2012-06-18
Dawid Jagiela
fixed merge renamed source file: newconf.f is now newconf.F
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commitdiff
2012-06-18
Dawid Jagiela
resolving merge conflicts
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commitdiff
2012-06-18
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
tree
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commitdiff
2012-06-18
Adam Liwo
Merge branch 'adam' into devel
tree
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commitdiff
2012-06-18
Dawid Jagiela
fixed indent for gfortran build in source/unres/src_MD...
tree
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commitdiff
2012-06-18
Dawid Jagiela
Merge branch 'devel' of mmka:unres into devel
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commitdiff
2012-06-18
Dawid Jagiela
removed MPI form CMakeLists.txt in xdrfpdb
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commitdiff
2012-06-18
Adam Kazimierz Sie...
Merge branch 'adasko' into devel
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commitdiff
2012-06-18
Adam Kazimierz Sie...
zmiany po usunieciu diagnostyki...
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commitdiff
2012-06-15
Adam Liwo
6/15/2012 by Adam
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commitdiff
2012-06-15
Adam Kazimierz Sie...
dzialajacy grad check....
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commitdiff
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