PyPI page
Author:
Nicolò Tampellini
Summary:
FIRECODE: Filtering Refiner and Embedder for Conformationally Dense Ensembles
Latest version:
2.0.4
Required dependencies:
ase
|
inquirerpy
|
matplotlib
|
mlfsm
|
networkx
|
numpy
|
openconf
|
prettytable
|
prism-pruner
|
psutil
|
racerts
|
rdkit
|
rich
|
scipy
|
sella
Optional dependencies:
aimnet
|
fairchem-core
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