Skip to content

Actions: forlilab/Meeko

Actions

All workflows

Actions

Loading...
Loading

Showing runs from all workflows
291 workflow runs
291 workflow runs

Filter by Event

Filter by Status

Filter by Branch

Filter by Actor

optionally allow breaking macrocycle bonds with A atom types (re-implements #106) Build/upload sdist and wheel Package to PyPI #39: Pull request #150 opened by diogomart
August 10, 2024 07:10 21s macrocycle_allow_A_atype
macrocycle_allow_A_atype
August 10, 2024 07:10 21s
check molecule consists of a single fragment and has no queries Build/upload sdist and wheel Package to PyPI #38: Pull request #120 synchronize by diogomart
August 9, 2024 23:56 18s check_fragments
check_fragments
August 9, 2024 23:56 18s
Combined PR #133 and PR #109 (superseeds #147) Build/upload sdist and wheel Package to PyPI #37: Pull request #149 opened by diogomart
August 9, 2024 22:30 19s reverted_revert
reverted_revert
August 9, 2024 22:30 19s
Combined PR #133 and PR #109 Build/upload sdist and wheel Package to PyPI #36: Pull request #147 synchronize by psharma-sr
August 9, 2024 21:15 24s pilotmerge
pilotmerge
August 9, 2024 21:15 24s
Combined PR #133 and PR #109 Build/upload sdist and wheel Package to PyPI #35: Pull request #147 synchronize by psharma-sr
August 9, 2024 16:51 22s pilotmerge
pilotmerge
August 9, 2024 16:51 22s
Added option to put pdbqts into subdirectories Build/upload sdist and wheel Package to PyPI #34: Pull request #123 synchronize by diogomart
August 8, 2024 01:00 19s multimol_subdirs
multimol_subdirs
August 8, 2024 01:00 19s
check molecule consists of a single fragment and has no queries Build/upload sdist and wheel Package to PyPI #32: Pull request #120 synchronize by diogomart
May 31, 2024 07:12 24s check_fragments
check_fragments
May 31, 2024 07:12 24s
v0.5.1 Build/upload sdist and wheel Package to PyPI #31: Release v0.5.1 published by nbruciaferri
May 22, 2024 21:07 24s
May 22, 2024 21:07 24s
Added option to put pdbqts into subdirectories Build/upload sdist and wheel Package to PyPI #30: Pull request #123 opened by allisonbarkdull
May 22, 2024 00:40 22s multimol_subdirs
multimol_subdirs
May 22, 2024 00:40 22s
check molecule consists of a single fragment and has no queries Build/upload sdist and wheel Package to PyPI #29: Pull request #120 opened by diogomart
May 19, 2024 00:36 22s check_fragments
check_fragments
May 19, 2024 00:36 22s
Fix charge parsing Build/upload sdist and wheel Package to PyPI #28: Pull request #117 opened by diogomart
May 3, 2024 22:35 22s fix_charge_parsing
fix_charge_parsing
May 3, 2024 22:35 22s
API CHANGE PDBQTReceptor init from string Build/upload sdist and wheel Package to PyPI #26: Pull request #107 opened by diogomart
April 26, 2024 17:14 27s pdbqt_receptor_init_string
pdbqt_receptor_init_string
April 26, 2024 17:14 27s
optionally allow breaking macrocycle bonds with A atom types Build/upload sdist and wheel Package to PyPI #25: Pull request #106 opened by diogomart
April 26, 2024 15:47 19s macrocycle_allow_A
macrocycle_allow_A
April 26, 2024 15:47 19s
reject rdkit mols with queries Build/upload sdist and wheel Package to PyPI #22: Pull request #90 opened by diogomart
March 5, 2024 02:09 23s reject_rdkit_query
reject_rdkit_query
March 5, 2024 02:09 23s
v0.6.0-alpha.3 - receptor prep Build/upload sdist and wheel Package to PyPI #21: Release v0.6.0-alpha.3 published by diogomart
February 2, 2024 07:35 28s
February 2, 2024 07:35 28s
Merge option to write vina-style grid box file Build/upload sdist and wheel Package to PyPI #20: Pull request #81 opened by althea-hansel
January 4, 2024 18:28 27s vina_gridfile
vina_gridfile
January 4, 2024 18:28 27s
ProTip! You can narrow down the results and go further in time using created:<2024-01-04 or the other filters available.