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WIREs Comput Mol Sci
Impact Factor: 14.016
Wiley Interdisciplinary Reviews:
Computational Molecular Science
Volume 4 Issue 2 (March/April 2014)
Page 91 - 168

Opinion

Compliance constants: are they of any real use?
Published Online: Jul 19 2013
DOI: 10.1002/wcms.1155
Abstract Full article on Wiley Online Library:   HTML | PDF

Overviews

Theory and simulation of atom tunneling in chemical reactions
Published Online: Aug 20 2013
DOI: 10.1002/wcms.1165
Abstract Full article on Wiley Online Library:   HTML | PDF
Semiempirical quantum–chemical methods
Published Online: Jul 19 2013
DOI: 10.1002/wcms.1161
Abstract Full article on Wiley Online Library:   HTML | PDF
Theoretical studies of nucleic acids folding
Published Online: Jul 12 2013
DOI: 10.1002/wcms.1146
Abstract Full article on Wiley Online Library:   HTML | PDF

Advanced Review

Symmetry‐adapted perturbation theory based on density functional theory for noncovalent interactions
Published Online: Aug 22 2013
DOI: 10.1002/wcms.1164
Abstract Full article on Wiley Online Library:   HTML | PDF

Software Focus

C hem S hell—a modular software package for QM / MM simulations
Published Online: Jul 19 2013
DOI: 10.1002/wcms.1163
Abstract Full article on Wiley Online Library:   HTML | PDF
Turbomole
Published Online: Jul 08 2013
DOI: 10.1002/wcms.1162
Abstract Full article on Wiley Online Library:   HTML | PDF

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