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Author:
None
License:
BSD 3-Clause License Copyright (c) 2018, National Technology & Engineering Solutions of Sandia, LLC (NTESS). Under the terms of Contract DE-NA0003525 with NTESS, the U.S. Government retains certain r...
Summary:
Automated reaction kinetics for gas-phase species
Latest version:
2.2.4
Required dependencies:
ase
|
networkx
|
numpy
|
rmsd
|
sella
Optional dependencies:
matplotlib
|
pyvis
|
rdkit
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