PyPI page
Author:
Rokas Elijošius
License:
MIT License Copyright (c) 2023 RokasEl Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated documentation files (the "Software"), to deal in t...
Summary:
None
Latest version:
0.3.1
Required dependencies:
ase
|
decorator
|
e3nn
|
einops
|
fire
|
frozendict
|
hydromace
|
mace-models
|
mace-torch
|
numpy
|
torch
|
typer
|
zndraw
|
znframe
Optional dependencies:
rdkit
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