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Open Babel presents a solution to the proliferation of multiple chemical file formats. In addition, it provides a variety of useful utilities from conformer searching and 2D depiction, to filtering, batch conversion, and substructure and similarity searching. For developers, it can be used as a programming library to handle chemical data in areas such as organic chemistry, drug design, materials science, and computational chemistry. It is freely available under an open-source license from http://openbabel.org.
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Noel M. O’Boyle
Michael Banck
Craig A. James
SHILAP Revista de lepidopterología
Journal of Cheminformatics
University of Pittsburgh
Technical University of Munich
University College Cork
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O’Boyle et al. (Fri,) studied this question.
www.synapsesocial.com/papers/69d5d3b82c8f994bcf1f2cd7 — DOI: https://doi.org/10.1186/1758-2946-3-33