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dfa & multichain cluster
[unres.git]
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source
/
2020-06-15
Cezary Czaplewski
dfa & multichain cluster
tree
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commitdiff
2020-06-07
Cezary Czaplewski
Adam's lipid and dfa corrections
tree
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commitdiff
2020-06-06
Cezary Czaplewski
Adam's cluster & unres corrections
tree
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commitdiff
2020-05-29
Cezary Czaplewski
time
tree
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commitdiff
2020-05-29
Cezary Czaplewski
corrections
tree
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commitdiff
2020-05-22
Cezary Czaplewski
cluster & wham update
tree
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commitdiff
2020-05-22
Cezary Czaplewski
Adam's corrections
tree
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commitdiff
2020-05-17
Cezary Czaplewski
homology energy correction
tree
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commitdiff
2020-05-02
Cezary Czaplewski
wham & cluster PBC
tree
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commitdiff
2020-04-19
Cezary Czaplewski
Adam's changes
tree
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commitdiff
2020-04-09
Cezary Czaplewski
Adam's corrections
tree
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commitdiff
2020-04-04
Cezary Czaplewski
cmake readpdb_mult.F
tree
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commitdiff
2020-04-04
Cezary Czaplewski
readpdb & fort.2 from unres
tree
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commitdiff
2020-04-01
Cezary Czaplewski
boxshift &readpdb
tree
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commitdiff
2020-03-28
Cezary Czaplewski
Adams corrections
tree
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commitdiff
2020-03-27
Cezary Czaplewski
Adam's 5D respa update
tree
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commitdiff
2020-03-26
Cezary Czaplewski
Adam's update
tree
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commitdiff
2020-03-24
Cezary Czaplewski
update 5D
tree
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commitdiff
2020-03-22
Cezary Czaplewski
Adam's update from okeanos
tree
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commitdiff
2020-03-14
Cezary Czaplewski
update from Adam
tree
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commitdiff
2020-03-14
Cezary Czaplewski
adam's update
tree
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commitdiff
2020-03-12
Cezary Czaplewski
update new files
tree
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commitdiff
2020-03-12
Cezary Czaplewski
update
tree
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commitdiff
2020-02-07
Cezary Czaplewski
homology from okeanos
tree
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commitdiff
2016-02-16
Adam Liwo
2/16/16
tree
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commitdiff
2015-01-12
Adam Liwo
Added files
tree
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commitdiff
2014-10-26
Adam Liwo
Commit new changes 10/26/14
tree
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commitdiff
2014-07-30
Adam Liwo
Adam 7/30/2014
tree
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commitdiff
2014-06-29
Adam Liwo
Commit Adam 6/29/2014
tree
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commitdiff
2014-06-29
Adam Liwo
Commit changes Adam
tree
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commitdiff
2014-05-04
Adam Liwo
Added homology restraints modified from Pawel and Magda...
tree
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commitdiff
2014-04-15
Adam Liwo
Adding cluster with newcorr
tree
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commitdiff
2014-04-15
Adam Liwo
Added wham, cluster for NEWCORR
tree
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commitdiff
2014-04-10
Adam Liwo
Added source/wham/src-NEWSC-NEWCORR/
tree
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commitdiff
2014-04-10
Adam Liwo
Added src_MD-M-newcorr (Adasko's source) and src-NEWSC...
tree
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commitdiff
2014-04-01
Adam Liwo
Added src_Eshel (decoy processing for threading)
tree
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commitdiff
2014-03-19
Adam Liwo
Fixed iatsc_s and iatscp_s for 1 residue (was 0 with...
tree
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commitdiff
2013-02-18
Adam Liwo
Added refsys,f
tree
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commitdiff
2013-02-18
Adam Liwo
refsys separated from readpdb in src_CDA_DiL
tree
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commitdiff
2013-02-17
Adam Liwo
Fixed addition of dummy residues for input UNRES pdb...
tree
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commitdiff
2013-02-17
Adam Liwo
added files deleted by merge with devel
tree
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commitdiff
2013-02-17
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
tree
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commitdiff
2013-02-17
Adam Liwo
Fixed the addition of dummy chain ends to structures...
tree
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commitdiff
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
tree
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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
tree
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commitdiff
2013-02-06
Bartlomiej Zaborowski
Files to working MD_DFA
tree
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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
tree
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commitdiff
2012-11-23
Dawid Jagiela
some gfortran warning fixes
tree
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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
tree
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commitdiff
2012-11-07
Dawid Jagiela
force legacy standard for gfortran
tree
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commitdiff
2012-11-07
Dawid Jagiela
gfortran legacy standard enforcement
tree
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commitdiff
2012-11-05
Dawid Jagiela
alignment fix in src_MD COMMON.SCCOR
tree
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commitdiff
2012-11-05
Dawid Jagiela
alignment fixes in src_MD COMMONs
tree
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commitdiff
2012-10-31
Dawid Jagiela
fix tcpu function in cluster/wham for gfortran
tree
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commitdiff
2012-10-31
Dawid Jagiela
Merge branch 'devel' of mmka:unres into devel
tree
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commitdiff
2012-10-31
Dawid Jagiela
tcpu function fix for gfortran
tree
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commitdiff
2012-10-31
Dawid Jagiela
CMake makro cinfo.f fix
tree
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commitdiff
2012-10-30
Dawid Jagiela
CMake unres/src_MIN missing sources fix
tree
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commitdiff
2012-10-17
Adam Kazimierz Sie...
Poprawka w Cmakelist
tree
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commitdiff
2012-10-17
Adam Liwo
10/17/2012 by Adam: Implemented sideadd correction...
tree
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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
tree
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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
tree
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commitdiff
2012-10-03
Bartlomiej Zaborowski
1. Fixed merge conflicts
tree
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commitdiff
2012-10-02
Bartlomiej Zaborowski
Merge branch 'bartek' into devel
tree
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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
tree
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commitdiff
2012-10-02
Bartlomiej Zaborowski
D i L aminokwasy dzialajace dla src_CSA
tree
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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"
tree
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commitdiff
2012-09-26
Bartlomiej Zaborowski
"Przygotowanie CSA do D i L aminokwasow"
tree
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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
tree
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commitdiff
2012-09-20
Adam Liwo
Sept 20/2012 by Adam: commit changes mostly in the...
tree
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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.
tree
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commitdiff
2012-07-31
Adam Kazimierz Sie...
poprawka clustrowania z potencjalami wsccor (zle czytan...
tree
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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
tree
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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
tree
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commitdiff
2012-07-18
Adam Kazimierz Sie...
modified Makefile
tree
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commitdiff
2012-07-18
Adam Kazimierz Sie...
hotfix parmread
tree
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commitdiff
2012-07-18
Adam Liwo
Implement minor changes on branch adam
tree
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commitdiff
2012-07-18
Adam Kazimierz Sie...
Revert "Merge branch 'adasko' into devel"
tree
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commitdiff
2012-07-18
Adam Kazimierz Sie...
Revert "poprawka przy liczeniu tau w clustrze"
tree
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commitdiff
2012-07-17
Adam Kazimierz Sie...
Merge branch 'adasko' into devel
tree
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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
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