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unres.git
2013-02-16
Cezary Czaplewski
type declaration in COMMON.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
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
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
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
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
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
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 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
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
new SCCORPAR for ctest
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2013-02-16
Cezary Czaplewski
common reorder to avoid padding in gfortran
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2013-02-16
Cezary Czaplewski
common reorder to avoid padding in gfortran
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2013-02-16
Cezary Czaplewski
small changes to compile in gfortran
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2013-02-16
Cezary Czaplewski
small changes to compile 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
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
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
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
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
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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2013-02-15
Cezary Czaplewski
dynamic SS from old Maurizio's code
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2013-02-14
Cezary Czaplewski
compilation only
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2013-02-14
Cezary Czaplewski
compilation only
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2013-02-10
Dawid Jagiela
added UNRES visualization plugin for PyMOL
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2013-02-10
Dawid Jagiela
added UNRES visualization plugin for PyMOL
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2013-02-07
Bartlomiej...
kosmetyczne zmiany do MD_DFA
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2013-02-07
Bartlomiej...
kosmetyczne zmiany do MD_DFA
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2013-02-06
Bartlomiej...
Merge branch 'devel' of mmka:unres into devel
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2013-02-06
Bartlomiej...
Merge branch 'devel' of mmka:unres into devel
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2013-02-06
Bartlomiej...
Files to working MD_DFA
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2013-02-06
Bartlomiej...
Files to working MD_DFA
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2013-02-06
Bartlomiej...
Working MD_DFA
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2013-02-06
Bartlomiej...
Working MD_DFA
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2013-02-06
Dawid Jagiela
added pymol/UNRESInpGen.py - generates inputs for MD
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2013-02-06
Dawid Jagiela
added pymol/UNRESInpGen.py - generates inputs for MD
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2013-01-10
Dawid Jagiela
fixed missing closing bracket
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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
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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2013-01-10
Dawid Jagiela
added UNRES_MD_FF setting for WHAM in (wham & cluster...
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2013-01-06
Adam Sieradzan
Wprowadzenie do Clustrowania D-aminokwasow w polu Yi
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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
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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2012-12-19
Dawid Jagiela
poprawki w COMMONAch
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2012-12-18
Adam Sieradzan
Usuniecie diagnostyki
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2012-12-12
Adam Kazimierz...
debud OFF
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2012-12-12
Adam Kazimierz...
Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
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2012-12-12
Andrei Niadzvedtski
debug ON w MD
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2012-12-12
Adam Kazimierz...
Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
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2012-12-10
Adam Sieradzan
zmiana w komonie
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2012-12-10
Adam Sieradzan
zmiana w COMMONIE
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2012-12-06
Adam Kazimierz...
Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
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2012-12-06
Adam Sieradzan
bugfix w whamie w parmreadzie
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2012-12-06
Adam Kazimierz...
zmiany w xdrfie
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2012-12-06
Adam Sieradzan
bugfix przekroczenia granic
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2012-12-05
Adam Sieradzan
zmaina w xdrf
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2012-12-04
Adam Sieradzan
bugfix w contact parm
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2012-12-04
Pawel Krupa
New examples based on current version of UNRES.
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2012-12-04
Pawel Krupa
New examples based on current version of UNRES.
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2012-12-04
Adam Kazimierz...
Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
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2012-12-04
Adam Kazimierz...
dodanie nowych contact do wham -m
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2012-12-03
Andrei Niadzvedtski
Zmiany w COMMONach
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2012-12-03
Adam Kazimierz...
poprawka w liczbie ntyp
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2012-12-03
Andrei Niadzvedtski
Zmiana w wham-m dla pola Yi
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2012-12-03
Adam Kazimierz...
Zmiany do WHAM-M dla pola Yi
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2012-11-30
Adam Sieradzan
zmiana w symetry (bugfix)
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2012-11-26
Adam Kazimierz...
Usuniecie diagnostyki w dzialajacym polu yi src_MD-M
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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 fixes in local_move.f, energy_p_new.F & initia...
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2012-11-23
Adam Kazimierz...
Dzialajace gradient dla src_MD-M dla pola Yi
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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
gfortran foxes in src_CSA/energy_p_new_barrier.F, src_C...
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2012-11-23
Adam Kazimierz...
Merge branch 'adasko' of mmka.chem.univ.gda.pl:unres...
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2012-11-23
Adam Kazimierz...
Zmiana w parametrach scinter_GB
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2012-11-23
Dawid Jagiela
fixed typos in initialize_p.F
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2012-11-23
Dawid Jagiela
fixed typos in initialize_p.F
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2012-11-23
Adam Sieradzan
zmiany w cmake i poprawka w pramreadzie
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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 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
gfortran fixes for src_MD-M
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