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extension of findClusterCenters() functionality
CI #302: Commit 9fa736c pushed by karolamik13
October 6, 2024 19:23 32m 35s interactions
October 6, 2024 19:23 32m 35s
commented lines removed
CI #301: Commit 1df3e9a pushed by karolamik13
October 2, 2024 13:07 32m 9s interactions
October 2, 2024 13:07 32m 9s
LOGGER info changed in calcStatisticsInteractions
CI #300: Commit 35228eb pushed by karolamik13
October 2, 2024 13:04 34m 9s interactions
October 2, 2024 13:04 34m 9s
showInteractionsHist - new function in InSty
CI #299: Commit 3d71056 pushed by karolamik13
October 2, 2024 11:42 31m 43s interactions
October 2, 2024 11:42 31m 43s
undisplaying path to the files with energies
CI #297: Commit b870860 pushed by karolamik13
October 2, 2024 09:00 33m 21s interactions
October 2, 2024 09:00 33m 21s
October 1, 2024 09:03 32m 30s
Merge pull request #1948 from karolamik13/interactions
CI #295: Commit 9639506 pushed by karolamik13
September 12, 2024 15:21 40m 10s interactions
September 12, 2024 15:21 40m 10s
another typo fix
CI #294: Commit 2db6ea9 pushed by jamesmkrieger
September 12, 2024 14:06 33m 13s interactions
September 12, 2024 14:06 33m 13s
add and for readability
CI #293: Commit 670db54 pushed by jamesmkrieger
September 12, 2024 13:28 42m 25s interactions
September 12, 2024 13:28 42m 25s
rename putDUMatom
CI #292: Commit e0f4d10 pushed by jamesmkrieger
September 12, 2024 13:26 32m 10s interactions
September 12, 2024 13:26 32m 10s
fix checkNonstandardResidues
CI #291: Commit 370e561 pushed by jamesmkrieger
September 12, 2024 13:25 32m 32s interactions
September 12, 2024 13:25 32m 32s
fix pkg_resources for PY3K
CI #290: Commit e1f4c6f pushed by jamesmkrieger
September 12, 2024 13:17 33m 6s interactions
September 12, 2024 13:17 33m 6s
fix replace type
CI #289: Commit 0ffa953 pushed by jamesmkrieger
September 12, 2024 13:07 31m 56s interactions
September 12, 2024 13:07 31m 56s
fix typos
CI #288: Commit 860c7b3 pushed by jamesmkrieger
September 12, 2024 12:49 32m 4s interactions
September 12, 2024 12:49 32m 4s
InSty [docs and checks improvements]
CI #287: Commit 95a9a0d pushed by karolamik13
September 12, 2024 06:43 30m 56s interactions
September 12, 2024 06:43 30m 56s
InSty - typos and TypeError fixed [James comments]
CI #286: Commit 11738ad pushed by karolamik13
September 11, 2024 20:47 31m 50s interactions
September 11, 2024 20:47 31m 50s
typo found by James
CI #285: Commit cf86d94 pushed by karolamik13
September 11, 2024 20:36 31m 32s interactions
September 11, 2024 20:36 31m 32s
typo in addMissingAtoms
CI #284: Commit 6c10c46 pushed by karolamik13
September 11, 2024 19:52 32m 39s interactions
September 11, 2024 19:52 32m 39s
addMissingAtoms() [fixer.py] - keep_ids added
CI #283: Commit d5de489 pushed by karolamik13
September 11, 2024 19:40 31m 12s interactions
September 11, 2024 19:40 31m 12s
September 10, 2024 20:49 31m 18s
September 10, 2024 12:28 34m 14s
getInteractions - replace for a single PDB interactions
CI #280: Commit 3a06083 pushed by karolamik13
September 10, 2024 09:53 32m 35s interactions
September 10, 2024 09:53 32m 35s
improvements of checkNonstandardResidues()
CI #279: Commit 6277f1d pushed by karolamik13
September 9, 2024 19:44 31m 25s interactions
September 9, 2024 19:44 31m 25s
saveInteractionsAsDummyAtoms fix with kwargs
CI #278: Commit def37bb pushed by karolamik13
September 8, 2024 20:01 31m 49s interactions
September 8, 2024 20:01 31m 49s