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pypi

mlmm-toolkit

Machine‑Learning / Molecular‑Mechanics (ML/MM) hybrid calculator and CLI toolset for Mechanistic Investigation of Enzymatic Reactions.

Activity

Latest release
1w ago
Total releases
12
Cadence
~5 days
Last 12 months
12

Reach

Stars
22

Details

License
unknown
First release
Mar 17, 2026
Releases
Version Released
0.3.4 patch
0.3.3 patch
0.3.1 patch
0.3.0 minor
0.2.8 patch
0.2.7 patch
0.2.6 patch
0.2.5 patch
0.2.4 initial
0.2.4.dev0 pre
0.2.3.dev0 pre
0.2.2.dev0 pre