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Author:
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License:
MIT License Copyright (c) 2024, Roman Zubatyuk Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated documentation files (the "Software"), to d...
Summary:
AIMNet Machine Learned Interatomic Potential
Latest version:
0.2.0
Required dependencies:
click
|
h5py
|
jinja2
|
numpy
|
nvalchemi-toolkit-ops
|
pyyaml
|
requests
|
torch
|
torch-sim-atomistic
|
warp-lang
Optional dependencies:
ase
|
huggingface-hub
|
omegaconf
|
pysisyphus
|
pytorch-ignite
|
safetensors
|
sella
|
wandb
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