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Commits
: Listings
Analyzed
12 months
ago. based on code collected
12 months
ago.
Dec 17, 2023 — Jan 16, 2024
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Fixes 7036 - middle line of triple bond meeting wedge (#7046)
David Cosgrove
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12 months ago
2 new projects using RDKit (#7049)
David Dalmau Ginesta
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12 months ago
New tests for specical query atoms and atropisomers (#7010)
tadhurst-cdd
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12 months ago
fix GCC 13.2 warnings about redundant move in return statement (#7029)
Riccardo Vianello
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12 months ago
Fixes #6472 - remove aromatic bond flags in Molhash anonymous graph (#7027)
Vincent F. Scalfani
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12 months ago
change the handling of autocommit flag to support sqlite3 connections (#7012)
Riccardo Vianello
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12 months ago
Fix 6957 (SpacialScore) (#7000)
Axel Pahl
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about 1 year ago
fix check (#7002)
Ric
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about 1 year ago
atropisomer handling added (#6903)
tadhurst-cdd
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about 1 year ago
[WIP] get deprecation CI working (#7004)
Greg Landrum
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about 1 year ago
Added fingerprints to GeneralizedSubstruct search and extended SWIG wrappers (#6991)
Gareth Jones
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about 1 year ago
Change the defaults for the conformer generation to be ETKDGv3 (#6985)
Greg Landrum
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about 1 year ago
Github6968 (#6979)
David Cosgrove
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about 1 year ago
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