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Merge branch 'master' of mmka.chem.univ.gda.pl:unres
[unres.git]
/
source
/
unres
/
src_MD
/ energy_p_new_barrier.F
2016-03-22
Cezary Czaplewski
imax0 replaced with max0
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2016-03-22
Cezary Czaplewski
imax0 replaced with max0
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2016-03-22
Cezary Czaplewski
energy_dec for esccor and some other debug printout
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2016-03-22
Cezary Czaplewski
energy_dec for esccor and some other debug printout
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2016-03-14
Cezary Czaplewski
eback_sc_corr do intertyp=1,3
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2016-03-14
Cezary Czaplewski
eback_sc_corr do intertyp=1,3
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2016-03-04
Cezary Czaplewski
Adam's changes to avoid wrong XG.. or ..GX sequence...
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2016-03-04
Cezary Czaplewski
Adam's changes to avoid wrong XG.. or ..GX sequence...
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2015-10-27
Cezary Czaplewski
ENERGY_DEC printout works for ESTR
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2015-10-27
Cezary Czaplewski
ENERGY_DEC printout works for ESTR
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2015-10-26
Cezary Czaplewski
ENERGY_DEC printout works for ebend in E0LL2Y forcefield
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2015-10-26
Cezary Czaplewski
ENERGY_DEC printout works for ebend in E0LL2Y forcefield
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2015-10-08
Cezary Czaplewski
energy_dec works with etors_d
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2015-10-08
Cezary Czaplewski
energy_dec works with etors_d
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2015-05-10
Adam Liwo
Merge branch 'prerelease-3.2.1' of mmka.chem.univ.gda...
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2015-05-10
Adam Liwo
Merge branch 'prerelease-3.2.1' of mmka.chem.univ.gda...
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2015-04-08
Adam Liwo
By Adam
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2015-04-08
Adam Liwo
By Adam
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2015-02-24
Adam Sieradzan
zmiany przywracajace TURN dla dummy i rozszerzajace...
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2015-02-24
Adam Sieradzan
zmiany przywracajace TURN dla dummy i rozszerzajace...
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2015-02-23
Adam Sieradzan
poprawka turn3 i turn4 uwaga moga byc wlaczone diagnostki
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2015-02-23
Adam Sieradzan
poprawka turn3 i turn4 uwaga moga byc wlaczone diagnostki
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2015-02-19
Adam Sieradzan
EBE change in prerealese-3.2.1 make dummy atom idependent
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2015-02-19
Adam Sieradzan
EBE change in prerealese-3.2.1 make dummy atom idependent
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2014-12-30
Adam Sieradzan
wprowadzenie do multichaina SCcorr
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2014-12-30
Adam Sieradzan
wprowadzenie do multichaina SCcorr
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2014-12-18
Adam Kazimierz Sie...
Wprowadzenie SCCOR dla wham-M
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2014-12-18
Adam Kazimierz Sie...
Wprowadzenie SCCOR dla wham-M
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2013-08-31
Adam Kazimierz Sie...
wylaczenie diagnostyki
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2013-08-31
Adam Kazimierz Sie...
wylaczenie diagnostyki
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2013-08-31
Adam Kazimierz Sie...
zmiany w prereleasie drobne
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2013-08-31
Adam Kazimierz Sie...
zmiany w prereleasie drobne
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2013-02-18
Cezary Czaplewski
dynamic dissulfides with finegrain parallelization...
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2013-02-18
Cezary Czaplewski
dynamic dissulfides with finegrain parallelization...
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2013-02-18
Cezary Czaplewski
dynamic dissulfides with finegrain parallelization
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2013-02-18
Cezary Czaplewski
dynamic dissulfides with finegrain parallelization
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2013-02-18
Adam Liwo
8/11/12 by Adam: fixed disulfide bridge problems
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2013-02-18
Adam Liwo
8/11/12 by Adam: fixed disulfide bridge problems
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2013-02-17
Cezary Czaplewski
dyn_ss writing pdb and ihpb cleaning
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2013-02-17
Cezary Czaplewski
dyn_ss writing pdb and ihpb cleaning
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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
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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2012-11-23
Dawid Jagiela
some gfortran warning fixes
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2012-11-23
Dawid Jagiela
some gfortran warning fixes
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2012-09-20
Adam Liwo
Update
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2012-09-20
Adam Liwo
Update
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2012-07-18
Adam Kazimierz Sie...
Revert "Merge branch 'adasko' into devel"
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2012-07-18
Adam Kazimierz Sie...
Revert "Merge branch 'adasko' into devel"
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2012-07-17
Adam Kazimierz Sie...
D i L aminokwasy dzialajace dla src_MD
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2012-07-17
Adam Kazimierz Sie...
D i L aminokwasy dzialajace dla src_MD
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2012-07-09
Adam Kazimierz Sie...
D i L aminokwasy tuz przed testami
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2012-07-09
Adam Kazimierz Sie...
D i L aminokwasy tuz przed testami
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2012-07-06
Adam Kazimierz Sie...
zmiana do DiL
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2012-07-06
Adam Kazimierz Sie...
zmiana do DiL
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2012-07-05
Adam Kazimierz Sie...
Rozgrzebany DIL
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2012-07-05
Adam Kazimierz Sie...
Rozgrzebany DIL
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2012-06-18
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
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2012-06-18
Adam Liwo
Merge branch 'devel' of mmka.chem.univ.gda.pl:unres...
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2012-06-18
Adam Kazimierz Sie...
Merge branch 'adasko' into devel
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2012-06-18
Adam Kazimierz Sie...
Merge branch 'adasko' into devel
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2012-06-18
Adam Kazimierz Sie...
zmiany po usunieciu diagnostyki...
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2012-06-18
Adam Kazimierz Sie...
zmiany po usunieciu diagnostyki...
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2012-06-15
Adam Kazimierz Sie...
dzialajacy grad check....
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2012-06-15
Adam Kazimierz Sie...
dzialajacy grad check....
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2012-06-14
Adam Kazimierz Sie...
Dzialajacy INTERTYP=1 i INTERTYP=2
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2012-06-14
Adam Kazimierz Sie...
Dzialajacy INTERTYP=1 i INTERTYP=2
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2012-06-05
Adam Kazimierz Sie...
UDALO SIE TERAZ DEBUG
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2012-06-05
Adam Kazimierz Sie...
UDALO SIE TERAZ DEBUG
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2012-05-29
Adam Kazimierz Sie...
kolejna
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2012-05-29
Adam Kazimierz Sie...
kolejna
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2012-05-29
Adam Kazimierz Sie...
zmienionwe zostaly i zostal chyba tylko int to cart...
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2012-05-29
Adam Kazimierz Sie...
zmienionwe zostaly i zostal chyba tylko int to cart...
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2012-05-29
Adam Kazimierz Sie...
sadas
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2012-05-29
Adam Kazimierz Sie...
sadas
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2012-05-13
Adam Liwo
5/13/2012 by Adam
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2012-05-13
Adam Liwo
5/13/2012 by Adam
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2012-05-13
Adam Liwo
5/13/2012 by Adam
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2012-05-13
Adam Liwo
5/13/2012 by Adam
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2012-05-10
Dawid Jagiela
closing asci-art frames in energy_p_new_barrier.F files...
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2012-05-10
Dawid Jagiela
closing asci-art frames in energy_p_new_barrier.F files...
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2012-05-10
Adam Liwo
5/10/2012 by Adam
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2012-05-10
Adam Liwo
5/10/2012 by Adam
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2012-04-19
Dawid Jagiela
CMake project files added
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2012-04-19
Dawid Jagiela
CMake project files added
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2012-03-28
Cezary Czaplewski
removal of CSA from MD version of code
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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
v.3.0
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2012-02-25
Dawid Jagieła
added source code
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