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Multiscale Simulation Methods for Nanomaterials

Richard B. Ross, Sanat Mohanty

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A Chemist's Guide to Valence Bond Theory

Sason S. Shaik, Philippe C. Hiberty

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The Quantum Theory of Atoms in Molecules: From Solid State to DNA and Drug Design

Chérif F. Matta, Russell J. Boyd, Axel Becke

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The Basics of Theoretical and Computational Chemistry

Bernd Michael Rode, Thomas S. Hofer, Michael D. Kugler

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Chemoinformatics: A Textbook

Johann Gasteiger, Thomas Engel

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Molecular Modelling for Beginners

Alan Hinchliffe
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