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ALCHEMI Batched Molecular Dynamics

modeltested · static-verifiedscore 45/100signed passport ✓published 21d ago · verified 2026-10-24

Atomistic Molecular Dynamics NIM with machine learning interatomic potentials. NVIDIA NIM: runs as an API on your own GPUs.

Declared tools (9)

drug-discoverygraph-neural-networksalchemihigh-performance-computingsimulation-and-modelingpytorchphysics-and-dynamics-simulationtriton-inference-serverhpc-/-supercomputing

model:ngc:nim/nvidia/alchemi-bmd