IOData: A python library for reading, writing, and converting computational chemistry file formats and generating input files - researchr publication authors

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Toon Verstraelen, William Adams, Leila Pujal, Alireza Tehrani, Braden D. Kelly, Luis Macaya, Fanwang Meng, Michael Richer, Raymundo Hernández-Esparza, Xiaotian Derrick Yang, Matthew Chan, Taewon David Kim, Maarten Cools-Ceuppens, Valerii Chuiko, Esteban Vöhringer-Martinez, Paul W. Ayers, Farnaz Heidar-Zadeh. IOData: A python library for reading, writing, and converting computational chemistry file formats and generating input files. Journal of Computational Chemistry, 42(6):458-464, 2021. [doi]

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