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0166c4aefc0300a40feda6669ec309fd2f610453
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1 Commits

Author SHA1 Message Date
Kevin Boyd
0166c4aefc Fix bug in inversion term for UFF, add finite difference checker. (#9228) 
* Fix copyright

* Address review comments

Removed finite diff from RDKit headers

Used explicit coordinates
 2026-04-30 14:20:51 +02:00