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The official sources for the RDKit library
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8
Last push
9mo ago
Recent commits
Latest commits.
Fixes #8689 (#8738)
6d8fca2
Greg Landrum
10mo ago
Expose CDX support to FileParsers and ChemDraw to SWIG (#8681)
cf269aa
Brian Kelley
10mo ago
patch the pubchem alignment code (#8733)
dbd9724
Greg Landrum
10mo ago
CanonicalizeConformer inverts structure (#8734)
d54d0c5
David Cosgrove
10mo ago
Fixes a bug with bad H positions in output conformer (#8731)
81226d8
Greg Landrum
10mo ago
Add the useRingTemplates option to generateDepictionMatching2DStructure (#8688)
be2b189
Ricardo Rodriguez
10mo ago
- expose RDK_BUILD_MINIMAL_LIB_RGROUPDECOMP in Code/MinimalLib/CMakeLists.txt (#8729)
dd04452
Paolo Tosco
10mo ago
document the way the 2D/3D flag in ctabs is handled (#8722)
b35ecc1
Greg Landrum
10mo ago
Top contributors
Builders behind this project.
greglandrum
5.6K commits
ptosco
501 commits
bp-kelley
278 commits
ricrogz
223 commits
DavidACosgrove
153 commits
rvianello
85 commits
sriniker
71 commits
gedeck
64 commits
