Economical and Accurate Protocol for Calculating Hydrogen-Bond-Acceptor Strengths-Reference-Cited by-同舟云学术

Economical and Accurate Protocol for Calculating Hydrogen-Bond-Acceptor Strengths

Author:

El Kerdawy Ahmed¹,Tautermann Christofer S.²,Clark Timothy¹³⁴,Fox Thomas²

Affiliation:

1. Computer-Chemie-Centrum, Friedrich-Alexander-Universität Erlangen-Nürnberg, Nägelsbachstraße 25, 91052 Erlangen, Germany

2. Computational Chemistry, Lead Identification and Optimization Support, Boehringer Ingelheim Pharma GmbH & Co. KG, 88397 Biberach, Germany

3. Interdisciplinary Center for Molecular Materials, Friedrich-Alexander-Universität Erlangen-Nürnberg, Nägelsbachstraße 49, 91052 Erlangen, Germany

4. Centre for Molecular Design, University of Portsmouth, King Henry Building, Portsmouth PO1 2DY, United Kingdom

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

Reference87 articles.

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2. Charting Hydrogen Bond Anisotropy;Journal of Chemical Theory and Computation;2020-02-27