mmka.chem.univ.gda.pl Git - unres4.git/history - source/unres/data/energy

2020-11-05	Adam Sieradzan	correction in new ions and clusterfix	blob \| commitdiff
2020-09-30	Anna Antoniak	Implementation of ions into NARES	blob \| commitdiff \| diff to current
2020-03-18	Adam Sieradzan	working cutoff	blob \| commitdiff \| diff to current
2020-01-03	Agnieszka Lipska	metal ions and protein interaction parameters - correct...	blob \| commitdiff \| diff to current
2019-11-25	Adam Sieradzan	working gradient for cations	blob \| commitdiff \| diff to current
2019-11-22	Adam Sieradzan	new ecat_prot energy is computed	blob \| commitdiff \| diff to current
2019-11-13	Agnieszka Lipska	New ions represetation	blob \| commitdiff \| diff to current
2019-11-12	Agnieszka Lipska	changes for new ion parametrization	blob \| commitdiff \| diff to current
2018-11-21	Adam Sieradzan	adding Debey screening and old torsion parm	blob \| commitdiff \| diff to current
2018-10-09	Adam Sieradzan	NEW CORR added to UNRES4	blob \| commitdiff \| diff to current
2018-05-07	Adam Sieradzan	renamining + shielding parallel	blob \| commitdiff \| diff to current

UNRESPACK 4.x