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ctest src_MD-M ref ene and missing files
[unres.git]
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source
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unres
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src_MD
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MREMD.F
2016-02-17
Cezary Czaplewski
correction for homol_nset>1 and waga_homology(iset...
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2015-11-30
Cezary Czaplewski
timlim function ovrtim only on master and MPI_Bcast
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2015-07-31
Adam Liwo
By AL: fixed FGPROCS>1 problem in HMREMD; iset passed...
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2015-05-14
Adam Liwo
Fixed the following components:
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2015-03-17
Cezary Czaplewski
remd with homol_nset>1 working with FG parallelization
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2015-03-03
Cezary Czaplewski
REMD with HOMOL_NSET>1 and single weight for all homolo...
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2015-02-25
Felipe Pineda
Merge branch 'master' of mmka.chem.univ.gda.pl:unres...
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2015-01-05
Adam Liwo
MREMD corrected; Langevin mode (bcast instead of scatte...
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2014-11-09
Cezary Czaplewski
restart is now working with HOMOL_NSET
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2014-11-07
Cezary Czaplewski
some corrections to 2D replica exchange with homology
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2014-11-07
Cezary Czaplewski
2D replica exchange with homology constraints
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2014-10-17
Felipe Pineda
Adam's homology version of unres with new readpdb.F...
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2013-05-07
Cezary Czaplewski
some corrections in xdrf2pdb-m for dyn_ss
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2013-04-08
Cezary Czaplewski
correct writing of dyn_ss for cx and x
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2012-05-13
Adam Liwo
5/13/2012 by Adam
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2012-03-28
Cezary Czaplewski
removal of CSA from MD version of code
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2012-02-25
Dawid Jagieła
added source code
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