Correct Bond Order Assignment in a Molecular Framework Using Integer Linear Programming with Application to Molecules Where Only Non-Hydrogen Atom Coordinates Are Available-Reference-Cited by-同舟云学术

Correct Bond Order Assignment in a Molecular Framework Using Integer Linear Programming with Application to Molecules Where Only Non-Hydrogen Atom Coordinates Are Available

Published:2005-06-17 Issue:5 Volume:45 Page:1267-1274
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Froeyen Matheus¹,Herdewijn Piet¹

Affiliation:

1. Laboratory for Medicinal Chemistry, Rega Institute, Catholic University of Leuven, Minderbroedersstraat 10, B-3000 Leuven, Belgium

Publisher

American Chemical Society (ACS)

Subject

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

Link

https://pubs.acs.org/doi/pdf/10.1021/ci049645z

Reference33 articles.

1. Abegg, Lewis, Langmuir, and the octet rule

2. Drawing Lewis Structures from Lewis Symbols: A Direct Electron-Pairing Approach

3. Intermolecular interactions from a natural bond orbital, donor-acceptor viewpoint

4. Finding a Kekule Structure in a Benzenoid System in Linear Time

5. Partitioning of π-Electrons in Rings of Polycyclic Benzenoid Hydrocarbons. 2. Catacondensed Coronoids

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