AtomicChargeCalculator: interactive web-based calculation of atomic charges in large biomolecular complexes and drug-like molecules

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Authors: Crina-Maria Ionescu, David Sehnal, Francesco L. Falginella, Purbaj Pant, Lukáš Pravda, Tomáš Bouchal, Radka Svobodová Vařeková, Stanislav Geidl, Jaroslav Koča

Journal title: Journal of Cheminformatics

Journal number: 17582946

Journal publisher: Chemistry Central

Published year: 2015

DOI identifier: 10.1186/s13321-015-0099-x

ISSN: 1758-2946