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Add explicit_hydrogen parameter
CI & CD #837: Pull request #741 synchronize by padix-key
February 23, 2025 14:04 38m 36s padix-key:rdkit
February 23, 2025 14:04 38m 36s
Integrate openmm into biotite.interface.openmm
CI & CD #836: Pull request #750 synchronize by padix-key
February 23, 2025 14:04 28m 27s padix-key:openmm
February 23, 2025 14:04 28m 27s
Fix RCSB test
CI & CD #835: Pull request #761 opened by padix-key
February 23, 2025 14:02 55m 6s padix-key:rcsb-fix
February 23, 2025 14:02 55m 6s
Validate and fix docstring formatting
CI & CD #834: Pull request #760 synchronize by padix-key
February 23, 2025 13:45 21m 11s padix-key:numpydoc
February 23, 2025 13:45 21m 11s
Validate and fix docstring formatting
CI & CD #833: Pull request #760 opened by padix-key
February 22, 2025 23:24 27m 36s padix-key:numpydoc
February 22, 2025 23:24 27m 36s
Integrate openmm into biotite.interface.openmm
CI & CD #832: Pull request #750 synchronize by padix-key
February 22, 2025 21:44 31m 52s padix-key:openmm
February 22, 2025 21:44 31m 52s
Integrate openmm into biotite.interface.openmm
CI & CD #831: Pull request #750 synchronize by padix-key
February 22, 2025 21:42 1m 29s padix-key:openmm
February 22, 2025 21:42 1m 29s
Integrate ammolite into biotite.interface.pymol
CI & CD #830: Pull request #749 synchronize by padix-key
February 22, 2025 21:41 20m 6s padix-key:pymol
February 22, 2025 21:41 20m 6s
Integrate openmm into biotite.interface.openmm
CI & CD #829: Pull request #750 synchronize by padix-key
February 22, 2025 21:37 5m 52s padix-key:openmm
February 22, 2025 21:37 5m 52s
Integrate openmm into biotite.interface.openmm
CI & CD #828: Pull request #750 synchronize by padix-key
February 22, 2025 15:45 26m 22s padix-key:openmm
February 22, 2025 15:45 26m 22s
Add explicit_hydrogen parameter
CI & CD #827: Pull request #741 synchronize by padix-key
February 22, 2025 07:10 21m 4s padix-key:rdkit
February 22, 2025 07:10 21m 4s
Integrate ammolite into biotite.interface.pymol
CI & CD #826: Pull request #749 synchronize by padix-key
February 20, 2025 09:58 31m 43s padix-key:pymol
February 20, 2025 09:58 31m 43s
Add explicit_hydrogen parameter
CI & CD #825: Pull request #741 synchronize by padix-key
February 20, 2025 09:44 31m 9s padix-key:rdkit
February 20, 2025 09:44 31m 9s
Merge pull request #752 from padix-key/tm-score
CI & CD #824: Commit a974bb8 pushed by padix-key
February 18, 2025 13:46 22m 28s main
February 18, 2025 13:46 22m 28s
Merge pull request #751 from padix-key/rings
CI & CD #823: Commit b893417 pushed by padix-key
February 18, 2025 09:42 47m 58s main
February 18, 2025 09:42 47m 58s
Do not filter anchors in step 2 of superimpose_structural_homologs()
CI & CD #822: Pull request #752 synchronize by padix-key
February 18, 2025 09:34 43m 26s padix-key:tm-score
February 18, 2025 09:34 43m 26s
Merge pull request #759 from padix-key/pdb
CI & CD #821: Commit ab26ece pushed by padix-key
February 18, 2025 09:33 33m 33s main
February 18, 2025 09:33 33m 33s
Add explicit_hydrogen parameter
CI & CD #820: Pull request #741 synchronize by padix-key
February 18, 2025 08:32 22m 43s padix-key:rdkit
February 18, 2025 08:32 22m 43s
Add explicit_hydrogen parameter
CI & CD #819: Pull request #741 synchronize by padix-key
February 15, 2025 22:38 20m 20s padix-key:rdkit
February 15, 2025 22:38 20m 20s
Add explicit_hydrogen parameter
CI & CD #818: Pull request #741 synchronize by padix-key
February 15, 2025 21:23 24m 23s padix-key:rdkit
February 15, 2025 21:23 24m 23s
Merge pull request #755 from davegrays/fix/atomarray-string-annotations
CI & CD #817: Commit 89f9510 pushed by padix-key
February 15, 2025 21:21 50m 13s main
February 15, 2025 21:21 50m 13s
Add new message indicating wrong PDB ID
CI & CD #816: Pull request #759 opened by padix-key
February 15, 2025 21:17 4m 21s padix-key:pdb
February 15, 2025 21:17 4m 21s
Add explicit_hydrogen parameter
CI & CD #815: Pull request #741 synchronize by padix-key
February 15, 2025 18:22 28m 15s padix-key:rdkit
February 15, 2025 18:22 28m 15s