PyPI page
Author:
Dinga Wonanke
License:
MIT
Summary:
A comprehensive Python toolkit for deconstructing metal-organic frameworks (MOFs) into building units, analysing porosity, removing unbound guest molecules, determining framework topology with RCSR net identification and generating cheminformatics descriptors for structural components.
Latest version:
0.1.9.1
Required dependencies:
ase
|
kaleido
|
msgpack
|
networkx
|
omsdetector-forked
|
openbabel-wheel
|
pyzeo
Optional dependencies:
plotly
|
rdkit
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