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calcSminaBindingAffinity - details availabe when atom_terms=True CI #207: Commit 05b6fdf pushed by karolamik13
November 9, 2023 08:03 35m 24s interactions
interactions
November 9, 2023 08:03 35m 24s
Improvements of calcSminaBindingAffinity CI #206: Commit 6339ee9 pushed by karolamik13
November 8, 2023 20:53 36m 56s interactions
interactions
November 8, 2023 20:53 36m 56s
stop_frame fix in multi-model PDB [SMINA and ligand interactions] CI #205: Commit 76080a9 pushed by karolamik13
November 8, 2023 20:13 29m 19s interactions
interactions
November 8, 2023 20:13 29m 19s
Merge pull request #1789 from karolamik13/interactions CI #204: Commit fecfa0e pushed by karolamik13
November 8, 2023 12:09 12m 1s interactions
interactions
November 8, 2023 12:09 12m 1s
Merge pull request #1789 from karolamik13/interactions CI #203: Commit fecfa0e pushed by karolamik13
November 8, 2023 12:09 37m 1s master
master
November 8, 2023 12:09 37m 1s
Merge pull request #1787 from karolamik13/interactions CI #202: Commit 0481c8a pushed by karolamik13
November 7, 2023 13:48 38m 5s master
master
November 7, 2023 13:48 38m 5s
Merge branch 'prody:master' into interactions CI #201: Commit e860952 pushed by karolamik13
November 7, 2023 13:48 28m 33s interactions
interactions
November 7, 2023 13:48 28m 33s
contact_min removed from calcFrequentInteractors() CI #200: Commit d780888 pushed by karolamik13
November 6, 2023 20:51 27m 51s interactions
interactions
November 6, 2023 20:51 27m 51s
fix kwargs usage CI #199: Commit 1a5d32a pushed by jamesmkrieger
November 6, 2023 14:10 34m 43s interactions
interactions
November 6, 2023 14:10 34m 43s
Merge branch 'prody:master' into interactions CI #198: Commit e4cc0ba pushed by karolamik13
November 6, 2023 11:13 33m 20s interactions
interactions
November 6, 2023 11:13 33m 20s
Merge pull request #1786 from jamesmkrieger/neighbours_seqdist CI #197: Commit 27e38ba pushed by karolamik13
November 6, 2023 11:13 31m 16s master
master
November 6, 2023 11:13 31m 16s
Correction with kwargs at line 552 [calcChHydrogenBonds()] CI #196: Commit 4123631 pushed by karolamik13
November 6, 2023 10:12 19m 23s interactions
interactions
November 6, 2023 10:12 19m 23s
Merge branch 'prody:master' into interactions CI #195: Commit eda7bdd pushed by karolamik13
November 3, 2023 17:38 32m 29s interactions
interactions
November 3, 2023 17:38 32m 29s
Merge pull request #1782 from jamesmkrieger/fix_parse_scipion_docs CI #194: Commit e5d0c8d pushed by karolamik13
November 3, 2023 17:37 30m 57s master
master
November 3, 2023 17:37 30m 57s
integrate smina functions CI #193: Commit 52f12c7 pushed by jamesmkrieger
November 3, 2023 16:39 31m 21s interactions
interactions
November 3, 2023 16:39 31m 21s
calcSminaBindingAffinity - scoring function added CI #192: Commit 7c1c8ff pushed by karolamik13
November 3, 2023 12:09 32m 18s interactions
interactions
November 3, 2023 12:09 32m 18s
Changes suggested by James [part 1] CI #191: Commit 67004ef pushed by karolamik13
October 30, 2023 20:42 25m 16s interactions
interactions
October 30, 2023 20:42 25m 16s
getLigandBindingAffinity using SMINA in protein-ligand interactions CI #190: Commit b018b33 pushed by karolamik13
October 30, 2023 10:40 35m 15s interactions
interactions
October 30, 2023 10:40 35m 15s
Changes suggested by James K. in protein-ligs interactions CI #189: Commit ab1c13b pushed by karolamik13
October 27, 2023 06:18 29m 39s interactions
interactions
October 27, 2023 06:18 29m 39s
Improvements of protein-lig interactions (multiple-chain corrections,… CI #188: Commit 07a7bd7 pushed by karolamik13
October 24, 2023 10:49 34m 56s interactions
interactions
October 24, 2023 10:49 34m 56s
multiple chain and ligands in saveInteractionsPDB CI #187: Commit a125d87 pushed by karolamik13
October 23, 2023 10:06 34m 6s interactions
interactions
October 23, 2023 10:06 34m 6s
New parameter in getLigandInteractions CI #186: Commit 9ba84b5 pushed by karolamik13
October 22, 2023 17:11 30m 33s interactions
interactions
October 22, 2023 17:11 30m 33s
setLigandInteractions in protein-ligand interactions CI #185: Commit 57ad214 pushed by karolamik13
October 21, 2023 20:15 35m 36s interactions
interactions
October 21, 2023 20:15 35m 36s
Merge branch 'prody:master' into interactions CI #184: Commit 6c0f6ef pushed by karolamik13
October 21, 2023 15:14 25m 41s interactions
interactions
October 21, 2023 15:14 25m 41s
Merge pull request #1780 from jamesmkrieger/prody-master CI #183: Commit d25551a pushed by karolamik13
October 21, 2023 15:14 35m 11s master
master
October 21, 2023 15:14 35m 11s