mmka.chem.univ.gda.pl Git - unres.git/search

2015-09-29	Adam Sieradzan	modified lipid parm	commit \| commitdiff \| tree
2015-09-23	Adam Sieradzan	bug fix in extconf	commit \| commitdiff \| tree
2015-09-22	Adam Sieradzan	working shielding	commit \| commitdiff \| tree
2015-09-08	Adam Sieradzan	Shielding part 2	commit \| commitdiff \| tree
2015-09-01	Adam Sieradzan	introduction of shielding effect (volume of overlap)	commit \| commitdiff \| tree
2015-08-06	Adam Sieradzan	Merge branch 'devel' into AFM	commit \| commitdiff \| tree
2015-08-06	Adam Sieradzan	first changes for shielding	commit \| commitdiff \| tree
2015-08-06	Adam Sieradzan	Merge branch 'AFM' into multichain	commit \| commitdiff \| tree
2015-08-06	Adam Sieradzan	intoduction of constant velocity for spring	commit \| commitdiff \| tree
2015-08-03	Adam Sieradzan	adding of sccor am1 parameter file	commit \| commitdiff \| tree
2015-08-03	Adam Sieradzan	1) debug of Lorentzian like constrains in cluster 2...	commit \| commitdiff \| tree
2015-08-02	Adam Sieradzan	first introduction of valence constrains - not working yet	commit \| commitdiff \| tree
2015-07-31	Adam Sieradzan	introduction of different ftors for each site	commit \| commitdiff \| tree
2015-07-31	Adam Sieradzan	First trial to introduce steered MD non successful	commit \| commitdiff \| tree
2015-07-28	Adam Sieradzan	Intoduction Lorentizan like restrains to cluster	commit \| commitdiff \| tree
2015-07-21	Adam Sieradzan	WHAM for Lorentzian like constrains fixed - DEBUG OFF	commit \| commitdiff \| tree
2015-07-20	Adam Sieradzan	debuging WHAM for constrains DEBUG ON	commit \| commitdiff \| tree
2015-07-17	Adam Sieradzan	first attempt to indroduce AFM velocity	commit \| commitdiff \| tree
2015-07-10	Adam Sieradzan	introduction of quartic an Lonrentz constrains to WHAM	commit \| commitdiff \| tree
2015-07-06	Adam Sieradzan	Merge branch 'multichain' of mmka:unres into multichain	commit \| commitdiff \| tree
2015-07-06	Adam Sieradzan	intoduction of quartic restrains in multichain, bugfix...	commit \| commitdiff \| tree
2015-07-03	Adam Sieradzan	WeFold Lorentzian like potentials introduction	commit \| commitdiff \| tree
2015-06-26	Adam Sieradzan	Changes suggested by Ana	commit \| commitdiff \| tree
2015-06-25	Adam Sieradzan	Merge branch 'lipid' into AFM	commit \| commitdiff \| tree
2015-06-25	Adam Sieradzan	removal of double returnbox	commit \| commitdiff \| tree
2015-06-25	Adam Sieradzan	Merge branch 'multichain' into lipid	commit \| commitdiff \| tree
2015-06-23	Adam Sieradzan	small fix in lipids	commit \| commitdiff \| tree
2015-05-27	Adam Sieradzan	working cluster for dyn_ss and triss	commit \| commitdiff \| tree
2015-05-26	Adam Sieradzan	Debug cluster part 2	commit \| commitdiff \| tree
2015-05-26	Adam Sieradzan	Cluster debug ON	commit \| commitdiff \| tree
2015-05-26	Adam Sieradzan	havebond turnoff	commit \| commitdiff \| tree
2015-05-26	Adam Sieradzan	correction of readrtns	commit \| commitdiff \| tree
2015-05-26	Adam Sieradzan	Merge branch 'devel' of mmka:unres into devel	commit \| commitdiff \| tree
2015-05-26	Adam Sieradzan	energy_dec to logical	commit \| commitdiff \| tree
2015-05-26	Adam Sieradzan	Introduction of dyn_ss and triss to cluster	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	hidden part of debug	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	nss*ebr removed	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	cxread debug 7	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	debug part 6	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	Debug 5	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	another DEBUG	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	dubug dss part 3	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	diffrent name for evdw	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	TRISS debug	commit \| commitdiff \| tree
2015-05-25	Adam Sieradzan	Warnig Debug ON	commit \| commitdiff \| tree
2015-05-24	Adam Sieradzan	Corrected WHAM and UNRES reading in SS dyn...	commit \| commitdiff \| tree
2015-05-23	Adam Sieradzan	Introduction of working dyn_ss and triss. Problems...	commit \| commitdiff \| tree
2015-05-23	Adam Sieradzan	Correction in readrtns	commit \| commitdiff \| tree
2015-05-23	Adam Sieradzan	Change in line of dyn_ss	commit \| commitdiff \| tree
2015-05-22	Adam Sieradzan	Merge branch 'devel' of mmka:unres into devel	commit \| commitdiff \| tree
2015-05-22	Adam Sieradzan	Adding dyn_ss and triss potentials to src-M wham	commit \| commitdiff \| tree
2015-05-06	Adam Sieradzan	correction in readpdb (bugfix)	commit \| commitdiff \| tree
2015-04-23	Adam Sieradzan	zmiany w geomout dla AFM	commit \| commitdiff \| tree
2015-04-17	Adam Sieradzan	Merge branch 'devel' of mmka:unres into devel	commit \| commitdiff \| tree
2015-04-17	Adam Sieradzan	poprawka w COMMON.SBRIDE dla triss	commit \| commitdiff \| tree
2015-04-17	Adam Sieradzan	Zaimplementowany AFM	commit \| commitdiff \| tree
2015-04-13	Adam Sieradzan	poprawka w intcartderiv	commit \| commitdiff \| tree
2015-04-13	Adam Sieradzan	Introduction of SS to newcorr and SSS to src_MD-M	commit \| commitdiff \| tree
2015-04-09	Adam Sieradzan	poprawka w pametrach	commit \| commitdiff \| tree
2015-03-25	Adam Sieradzan	important change for single processor for multi-chain	commit \| commitdiff \| tree
2015-03-19	Adam Sieradzan	chyba dzialajacy lipid	commit \| commitdiff \| tree
2015-03-18	Adam Sieradzan	Merge branch 'multichain' into lipid	commit \| commitdiff \| tree
2015-03-18	Adam Sieradzan	correction of correlation potentials	commit \| commitdiff \| tree
2015-03-18	Adam Sieradzan	poprawki w potencjalach	commit \| commitdiff \| tree
2015-03-16	Adam Sieradzan	drobne poprawki	commit \| commitdiff \| tree
2015-03-04	Adam Sieradzan	Merge branch 'multichain' of mmka:unres into lipid	commit \| commitdiff \| tree
2015-03-04	Adam Sieradzan	correction in multichain	commit \| commitdiff \| tree
2015-03-04	Adam Sieradzan	introduce lipid good grad wrong symplex	commit \| commitdiff \| tree
2015-02-24	Adam Sieradzan	Merge branch 'master' into multichain	commit \| commitdiff \| tree
2015-02-19	Adam Sieradzan	poprawki w ANG w src_MD-M	commit \| commitdiff \| tree
2015-02-10	Adam Sieradzan	wprowadzenie lipidow	commit \| commitdiff \| tree
2015-01-29	Adam Liwo	Corrected refsys.f in src_MD-M	commit \| commitdiff \| tree
2015-01-29	Adam Sieradzan	Introduction of lipid energy transfer	commit \| commitdiff \| tree
2014-12-17	Adam Sieradzan	Merge branch 'master' of mmka:unres	commit \| commitdiff \| tree
2014-12-17	Adam Sieradzan	zmiany w gitignore	commit \| commitdiff \| tree
2014-12-17	Adam Sieradzan	Merge branch 'master' of mmka:unres into multichain	commit \| commitdiff \| tree
2014-10-23	Adam Sieradzan	Merge branch 'multichain' of mmka:unres into multichain	commit \| commitdiff \| tree
2014-10-23	Adam Sieradzan	poprawka w stochasticfric	commit \| commitdiff \| tree
2014-09-10	Adam Sieradzan	correction of xdrf2pdb	commit \| commitdiff \| tree
2014-07-22	Adam Sieradzan	correction in MD returnbox	commit \| commitdiff \| tree
2014-06-24	Adam Sieradzan	bug fix for langevin dynamics	commit \| commitdiff \| tree
2014-06-24	Adam Sieradzan	Merge branch 'devel' of mmka:unres into devel	commit \| commitdiff \| tree
2014-06-24	Adam Sieradzan	bug fix for langevin dynamics	commit \| commitdiff \| tree
2014-06-12	Adam Sieradzan	compiling cluster before tests	commit \| commitdiff \| tree
2014-06-10	Adam Sieradzan	Introduction of PBC to cluster energy and reading,...	commit \| commitdiff \| tree
2014-06-10	Adam Sieradzan	Bug fix for reading single residue from pdb	commit \| commitdiff \| tree
2014-05-25	Adam Sieradzan	zmiany w multichainie	commit \| commitdiff \| tree
2014-05-13	Adam Sieradzan	Wylacznie timiningu i sprawdzenie gradientu	commit \| commitdiff \| tree
2014-05-12	Adam Sieradzan	po przyspieszeniu przed checkgradem i sympcheckiem	commit \| commitdiff \| tree
2014-05-08	Adam Sieradzan	wlaczenie timing	commit \| commitdiff \| tree
2014-05-08	Adam Sieradzan	Merge branch 'devel' of mmka:unres into devel	commit \| commitdiff \| tree
2014-05-08	Adam Sieradzan	Adjusted energy file (small improvement)	commit \| commitdiff \| tree
2014-05-01	Adam Sieradzan	polepszenie wydajnosci algorytmu PBC	commit \| commitdiff \| tree
2014-03-18	Adam Sieradzan	Devel ma zle COMMON.TORSIONAL w src_MD (single chain)	commit \| commitdiff \| tree
2014-03-04	Adam Sieradzan	ignorowanie build theta	commit \| commitdiff \| tree
2014-03-03	Adam Sieradzan	poprawka w refsysie	commit \| commitdiff \| tree
2014-02-24	Adam Sieradzan	Working gradient for PBC	commit \| commitdiff \| tree
2014-02-20	Adam Sieradzan	Drobne zmiany i dodanei parametrow dla dummy atom	commit \| commitdiff \| tree
2014-02-17	Adam Sieradzan	The wrong one gradient compontent...	commit \| commitdiff \| tree
2014-02-08	Adam Sieradzan	zmiany w galezi multichain	commit \| commitdiff \| tree
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