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delete receptor pdbqt class and methods Python application #109: Pull request #499 synchronize by diogomart
29s move_pdbqt_receptor
move_pdbqt_receptor
29s
delete receptor pdbqt class and methods Build/upload sdist and wheel Package to PyPI #565: Pull request #499 synchronize by diogomart
55s move_pdbqt_receptor
move_pdbqt_receptor
55s
delete receptor pdbqt class and methods Build/upload sdist and wheel Package to PyPI #564: Pull request #499 opened by maylinnp
17s move_pdbqt_receptor
move_pdbqt_receptor
17s
delete receptor pdbqt class and methods Python application #108: Pull request #499 opened by maylinnp
23s move_pdbqt_receptor
move_pdbqt_receptor
23s
Merge pull request #496 from forlilab/solpar_offset Python application #107: Commit 1eac18b pushed by diogomart
34s develop
develop
34s
add argument to offset solvation parameter Python application #106: Pull request #496 opened by diogomart
34s solpar_offset
solpar_offset
34s
add argument to offset solvation parameter Build/upload sdist and wheel Package to PyPI #563: Pull request #496 opened by diogomart
22s solpar_offset
solpar_offset
22s
fix: define standard residue connectivity before sanitisation Build/upload sdist and wheel Package to PyPI #562: Pull request #495 synchronize by ajrcampbell
22s ajrcampbell:template-connectivity-before-sanitization
ajrcampbell:template-connectivity-before-sanitization
22s
fix: define standard residue connectivity before sanitisation Python application #105: Pull request #495 synchronize by ajrcampbell
45s ajrcampbell:template-connectivity-before-sanitization
ajrcampbell:template-connectivity-before-sanitization
45s
fix: define standard residue connectivity before sanitisation Python application #104: Pull request #495 opened by ajrcampbell
Action required ajrcampbell:template-connectivity-before-sanitization
ajrcampbell:template-connectivity-before-sanitization
Action required
fix: define standard residue connectivity before sanitisation Build/upload sdist and wheel Package to PyPI #561: Pull request #495 opened by ajrcampbell
Action required ajrcampbell:template-connectivity-before-sanitization
ajrcampbell:template-connectivity-before-sanitization
Action required
v0.8.0 Build/upload sdist and wheel Package to PyPI #560: Release v0.8.0 published by diogomart
20s
20s
Merge pull request #494 from forlilab/v0.8.0 Python application #103: Commit deaa473 pushed by diogomart
40s develop
develop
40s
update version strings to 0.8.0 Build/upload sdist and wheel Package to PyPI #559: Pull request #494 opened by diogomart
21s v0.8.0
v0.8.0
21s
update version strings to 0.8.0 Python application #102: Pull request #494 opened by diogomart
31s v0.8.0
v0.8.0
31s
Merge pull request #493 from forlilab/491 Python application #101: Commit 6a98ea1 pushed by diogomart
38s develop
develop
38s
Fixes excessive verbosity of #492 Build/upload sdist and wheel Package to PyPI #558: Pull request #493 opened by diogomart
19s 491
491
19s
Fixes excessive verbosity of #492 Python application #100: Pull request #493 opened by diogomart
39s 491
491
39s
Merge pull request #486 from forlilab/adjacent_padding Python application #99: Commit 95ec747 pushed by diogomart
37s develop
develop
37s
fix: handle mmCIF null charge markers ('?', '.') in from_cif (#491) Python application #98: Pull request #492 opened by ethanhawkes-gif
36s ethanhawkes-gif:fix/issue-491-cif-null-charge-marker
ethanhawkes-gif:fix/issue-491-cif-null-charge-marker
36s
fix: handle mmCIF null charge markers ('?', '.') in from_cif (#491) Build/upload sdist and wheel Package to PyPI #557: Pull request #492 opened by ethanhawkes-gif
25s ethanhawkes-gif:fix/issue-491-cif-null-charge-marker
ethanhawkes-gif:fix/issue-491-cif-null-charge-marker
25s
perf: query the KD-tree once per structure in _identify_bonds Python application #97: Pull request #490 opened by JustinKyleKirkland
33s JustinKyleKirkland:perf-batch-kdtree-bond-perception
JustinKyleKirkland:perf-batch-kdtree-bond-perception
33s
perf: query the KD-tree once per structure in _identify_bonds Build/upload sdist and wheel Package to PyPI #556: Pull request #490 opened by JustinKyleKirkland
23s JustinKyleKirkland:perf-batch-kdtree-bond-perception
JustinKyleKirkland:perf-batch-kdtree-bond-perception
23s
fix: keep receptor atom index aligned with the atoms array Python application #96: Pull request #489 opened by JustinKyleKirkland
36s JustinKyleKirkland:fix-receptor-pdbqt-atom-index
JustinKyleKirkland:fix-receptor-pdbqt-atom-index
36s
fix: keep receptor atom index aligned with the atoms array Build/upload sdist and wheel Package to PyPI #555: Pull request #489 opened by JustinKyleKirkland
23s JustinKyleKirkland:fix-receptor-pdbqt-atom-index
JustinKyleKirkland:fix-receptor-pdbqt-atom-index
23s