#

lfmo

Here is 1 public repository matching this topic...

CCcolab / AI4S-OrgChem

AI4S Agent independent PySCF replication of Yu P1-P9: 8 agree + 1 dissent (P1). Freeze 2026-08-25.

machine-learning computational-chemistry symbolic-regression quantum-chemistry reproducibility organic-chemistry electronic-structure pyscf aromaticity ai-for-science ai4s lfmo chemical-theory

Updated Sep 6, 2026
Python

Add this topic to your repo

To associate your repository with the lfmo topic, visit your repo's landing page and select "manage topics."