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theochem/iodata

Python library for reading, writing, and converting computational chemistry file formats and generating input files.

Owner
theochem (organization)
Stars
Stars: 172
Forks
Forks: 60
Language
Python
License
LGPL-3.0
Created
2017
Topics
quantum-chemistryquantum-chemistry-programsquantum-chemistry-packagescomputational-chemistrycomputational-biologycomputational-physicsfile-format-converterdata-parsingjson-schematheoretical-chemistry
Tier
Prototype (100 to 249 ★) What this tier means
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