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zmiany w Cmake i dodanie sprawdzenia gradientu
[unres.git]
/
source
/
unres
/
2014-03-14
Adam Sieradzan
zmiany w Cmake i dodanie sprawdzenia gradientu
tree
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commitdiff
2014-03-10
Adam Sieradzan
wlaczona diagnostyka grad
tree
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commitdiff
2014-03-04
Adam Sieradzan
Drobna poprawka w gradiencie i wylaczenie pisania
tree
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commitdiff
2014-03-04
Adam Sieradzan
zmiany w wydruku
tree
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commitdiff
2014-03-04
Adam Sieradzan
Zmiany w potencjalach
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commitdiff
2013-11-18
Adam Sieradzan
dzialajacy gradient
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commitdiff
2013-11-14
Adam Sieradzan
zabezpieczenie przedczarkowe
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commitdiff
2013-11-05
Adam Sieradzan
Debug part 6
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commitdiff
2013-11-05
Adam Sieradzan
Debug part 5
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commitdiff
2013-11-05
Adam Sieradzan
Debug part 4
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commitdiff
2013-11-05
Adam Sieradzan
Debug part 3
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commitdiff
2013-11-05
Adam Sieradzan
Debug part 2
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commitdiff
2013-11-05
Adam Sieradzan
Merge branch 'adasko' into devel
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commitdiff
2013-11-05
Adam Sieradzan
pierwsza proba merga devela do adasko
tree
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commitdiff
2013-10-30
Cezary Czaplewski
Makefile for pgi 2013
tree
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commitdiff
2013-10-30
Cezary Czaplewski
testing Makefile for pgi compiler
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commitdiff
2013-09-02
Dawid Jagiela
resolved conflicts in: source/unres/src_MD/CMakeLists.txt
tree
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commitdiff
2013-09-02
Cezary Czaplewski
repair of broken merge
tree
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commitdiff
2013-09-02
Cezary Czaplewski
Merge branch 'devel' of mmka:unres into devel
tree
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commitdiff
2013-09-02
Cezary Czaplewski
merging devel
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commitdiff
2013-08-31
Adam Kazimierz Sie...
1)Clean-up 2)making similar src_MD and its multichain...
tree
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commitdiff
2013-08-31
Adam Kazimierz Sie...
Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
tree
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commitdiff
2013-08-31
Adam Kazimierz Sie...
Clean-up in parmread for src-MD and src-MD-M
tree
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commitdiff
2013-08-23
Dawid Jagiela
Fix to use native system xdr headers
tree
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commitdiff
2013-07-25
Dawid Jagiela
test name changed for unres MD DFA version
tree
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commitdiff
2013-07-25
Dawid Jagiela
test name changed for unres MD DFA version
tree
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commitdiff
2013-07-25
Dawid Jagiela
Merge branch 'prerelease-3.2.1' into devel
tree
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commitdiff
2013-07-25
Dawid Jagiela
Merge branch 'prerelease-3.2.1' into devel
tree
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commitdiff
2013-07-16
Adam Sieradzan
NIE PEWNE ZMIANY ZWERYFIKUJ!!
tree
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commitdiff
2013-05-07
Cezary Czaplewski
some corrections in xdrf2pdb-m for dyn_ss
tree
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commitdiff
2013-05-07
Cezary Czaplewski
some corrections in xdrf2pdb-m for dyn_ss
tree
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commitdiff
2013-04-12
Dawid Jagiela
added default preprocessor flags for unknown compilers
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commitdiff
2013-04-12
Dawid Jagiela
added default preprocessor flags for unknown compilers
tree
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commitdiff
2013-04-08
Cezary Czaplewski
correct writing of dyn_ss for cx and x
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commitdiff
2013-04-08
Cezary Czaplewski
correct writing of dyn_ss for cx and x
tree
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commitdiff
2013-02-19
Cezary Czaplewski
cleaning of gfortran warnings in src_MD_DFA
tree
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commitdiff
2013-02-19
Cezary Czaplewski
cleaning of gfortran warnings in src_MD_DFA
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commitdiff
2013-02-19
Cezary Czaplewski
cleaning of gfortran warnings
tree
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commitdiff
2013-02-19
Cezary Czaplewski
cleaning of gfortran warnings
tree
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commitdiff
2013-02-19
Cezary Czaplewski
copy DFA cleaning of types from CSA to MD
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commitdiff
2013-02-19
Cezary Czaplewski
copy DFA cleaning of types from CSA to MD
tree
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commitdiff
2013-02-19
Cezary Czaplewski
repairs error in merge
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commitdiff
2013-02-19
Cezary Czaplewski
repairs error in merge
tree
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commitdiff
2013-02-19
Cezary Czaplewski
Merge branch 'prerelease-3.2.1' into devel
tree
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commitdiff
2013-02-19
Cezary Czaplewski
Merge branch 'prerelease-3.2.1' into devel
tree
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commitdiff
2013-02-19
Cezary Czaplewski
dyn_ss and other finegrain printout cleaning
tree
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commitdiff
2013-02-19
Cezary Czaplewski
dyn_ss and other finegrain printout cleaning
tree
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commitdiff
2013-02-18
Cezary Czaplewski
dynamic dissulfides with finegrain parallelization...
tree
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commitdiff
2013-02-18
Cezary Czaplewski
dynamic dissulfides with finegrain parallelization...
tree
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commitdiff
2013-02-18
Cezary Czaplewski
Merge branch 'prerelease-3.2.1' of mmka:unres into...
tree
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commitdiff
2013-02-18
Cezary Czaplewski
Merge branch 'prerelease-3.2.1' of mmka:unres into...
tree
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commitdiff
2013-02-18
Cezary Czaplewski
dynamic dissulfides with finegrain parallelization
tree
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commitdiff
2013-02-18
Cezary Czaplewski
dynamic dissulfides with finegrain parallelization
tree
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commitdiff
2013-02-18
Adam Liwo
Added refsys.f to src_CSA_DiL
tree
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commitdiff
2013-02-18
Adam Liwo
Added refsys.f to src_CSA_DiL
tree
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commitdiff
2013-02-18
Adam Liwo
Added refsys,f
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commitdiff
2013-02-18
Adam Liwo
Added refsys,f
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commitdiff
2013-02-18
Adam Liwo
refsys deleted from readpdb.F in srd_CSA_DiL
tree
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commitdiff
2013-02-18
Adam Liwo
refsys deleted from readpdb.F in srd_CSA_DiL
tree
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commitdiff
2013-02-18
Adam Liwo
refsys separated from readpdb in src_CDA_DiL
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commitdiff
2013-02-18
Adam Liwo
refsys separated from readpdb in src_CDA_DiL
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commitdiff
2013-02-18
Adam Liwo
Added refsysy to Cmakelists
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commitdiff
2013-02-18
Adam Liwo
Added refsysy to Cmakelists
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commitdiff
2013-02-18
Adam Liwo
8/11/12 by Adam: fixed disulfide bridge problems
tree
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commitdiff
2013-02-18
Adam Liwo
8/11/12 by Adam: fixed disulfide bridge problems
tree
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commitdiff
2013-02-18
Cezary Czaplewski
compilation only
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commitdiff
2013-02-18
Cezary Czaplewski
compilation only
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
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
added files deleted by merge with devel
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
2013-02-17
Adam Liwo
Fixed the addition of dummy chain ends to structures...
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
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
2013-02-17
Adam Liwo
Fixed the addition of dummy chain ends to structures...
tree
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commitdiff
2013-02-17
Cezary Czaplewski
dyn_ss writing pdb and ihpb cleaning
tree
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commitdiff
2013-02-17
Cezary Czaplewski
dyn_ss writing pdb and ihpb cleaning
tree
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commitdiff
2013-02-16
Cezary Czaplewski
more type cleaning in DFA
tree
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commitdiff
2013-02-16
Cezary Czaplewski
more type cleaning in DFA
tree
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commitdiff
2013-02-16
Cezary Czaplewski
type declaration in COMMON.DFA
tree
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commitdiff
2013-02-16
Cezary Czaplewski
type declaration in COMMON.DFA
tree
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commitdiff
2013-02-16
Cezary Czaplewski
no type declaration in common
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commitdiff
2013-02-16
Cezary Czaplewski
no type declaration in common
tree
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commitdiff
2013-02-16
Cezary Czaplewski
no type declaration in common
tree
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commitdiff
2013-02-16
Cezary Czaplewski
no type declaration in common
tree
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commitdiff
2013-02-16
Cezary Czaplewski
classical Makefile cleaning
tree
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commitdiff
2013-02-16
Cezary Czaplewski
classical Makefile cleaning
tree
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commitdiff
2013-02-16
Cezary Czaplewski
rename common sccorin src_CSA
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commitdiff
2013-02-16
Cezary Czaplewski
rename common sccorin src_CSA
tree
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commitdiff
2013-02-16
Cezary Czaplewski
src_MD-M compiles with old Makefile and common sccor...
tree
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commitdiff
2013-02-16
Cezary Czaplewski
src_MD-M compiles with old Makefile and common sccor...
tree
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commitdiff
2013-02-16
Cezary Czaplewski
common name correction
tree
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commitdiff
2013-02-16
Cezary Czaplewski
common name correction
tree
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commitdiff
2013-02-16
Cezary Czaplewski
prng and not prng_32 for gfortran
tree
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commitdiff
2013-02-16
Cezary Czaplewski
prng and not prng_32 for gfortran
tree
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commitdiff
2013-02-16
Cezary Czaplewski
prng and not prng_32 for f95
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commitdiff
2013-02-16
Cezary Czaplewski
prng and not prng_32 for f95
tree
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commitdiff
2013-02-16
Cezary Czaplewski
new SCCORPAR for ctest
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commitdiff
next