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Very Low Activity
Commits
: Listings
Analyzed
1 day
ago. based on code collected
2 days
ago.
Nov 15, 2024 — Nov 15, 2025
Showing page 19 of 394
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Merge remote-tracking branch 'upstream/master'
Rocco Meli
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about 6 years ago
Use canonical SMILES to check stereochemistry
Naruki Yoshikawa
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about 6 years ago
Merge remote-tracking branch 'upstream/master' into some_tests
David Koes
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about 6 years ago
Merge remote-tracking branch 'upstream/master' into some_tests
David Koes
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about 6 years ago
Convert atom id to atom index
Naruki Yoshikawa
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about 6 years ago
Move BFGS library
Naruki Yoshikawa
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about 6 years ago
Merge pull request #2026 from n-yoshikawa/fix-obabel-fast
Geoff Hutchison
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about 6 years ago
Merge pull request #2026 from n-yoshikawa/fix-obabel-fast
Geoff Hutchison
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about 6 years ago
Update coordinates in fast option of obabel
Naruki Yoshikawa
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about 6 years ago
Update coordinates in fast option of obabel
Naruki Yoshikawa
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about 6 years ago
Add MMFF94s tests and MMFF94 + dielectric constant unit tests.
Geoff Hutchison
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about 6 years ago
Add MMFF94s tests and MMFF94 + dielectric constant unit tests.
Geoff Hutchison
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about 6 years ago
Add force field support for dielectric constants in charge terms.
Geoff Hutchison
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about 6 years ago
Add force field support for dielectric constants in charge terms.
Geoff Hutchison
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about 6 years ago
Merge pull request #2012 from Artoria2e5/patch-1
Geoff Hutchison
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about 6 years ago
Merge pull request #2012 from Artoria2e5/patch-1
Geoff Hutchison
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about 6 years ago
Merge pull request #1980 from e-kwsm/update-mol-url
Geoff Hutchison
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about 6 years ago
Merge pull request #1980 from e-kwsm/update-mol-url
Geoff Hutchison
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about 6 years ago
add quotes (#1988)
Rocco Meli
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about 6 years ago
add quotes (#1988)
Rocco Meli
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about 6 years ago
PDB and PDBQT Insertion Code Fixes (#1998)
Rocco Meli
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about 6 years ago
PDB and PDBQT Insertion Code Fixes (#1998)
Rocco Meli
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about 6 years ago
Merge remote-tracking branch 'upstream/master'
Rocco Meli
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about 6 years ago
Merge remote-tracking branch 'upstream/master'
Rocco Meli
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about 6 years ago
Merge pull request #2017 from PeaWagon/master
Geoff Hutchison
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about 6 years ago
Merge pull request #2017 from PeaWagon/master
Geoff Hutchison
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about 6 years ago
change forcefield.cpp so that steepest descent and conjugate gradients update maxgrad; proposed fix for github issue 1366
Jen Garner
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about 6 years ago
change forcefield.cpp so that steepest descent and conjugate gradients update maxgrad; proposed fix for github issue 1366
Jen Garner
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about 6 years ago
Merge remote-tracking branch 'upstream/master'
Rocco Meli
More...
about 6 years ago
Merge remote-tracking branch 'upstream/master'
Rocco Meli
More...
about 6 years ago
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