peastman /mlipbenchmarks
Machine learning potential benchmarking
★ 12 · Updated 6mo ago · MIT
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Last commit 2026-01-25
The year the source list gave; the exact date was not checked.
peastman /mlipbenchmarks
Machine learning potential benchmarking
★ 12 · Updated 6mo ago · MIT
No description
★ — · Updated unknown · Licence unknown
No description
★ — · Updated unknown · Licence unknown
0217ljh /ColdDDI
ColdDDI: Evaluating Knowledge Utilization in Cold-Start Drug-Drug Interaction Prediction
★ — · Updated unknown · Licence unknown
atomistic-machine-learning /SchNet
Atomistic system property prediction
★ 944 · Updated 2d ago · Licence unknown
gasteigerjo /DimeNet
Molecular graph property prediction
★ 361 · Updated 3y ago · Licence unknown