General Molecular Mechanics Method for Transition Metal Carboxylates and its Application to the Multiple Coordination Modes in Mono- and Dinuclear Mn(II) Complexes-Reference-Cited by-同舟云学术

General Molecular Mechanics Method for Transition Metal Carboxylates and its Application to the Multiple Coordination Modes in Mono- and Dinuclear Mn(II) Complexes

Published:2008-07-03 Issue:15 Volume:47 Page:6711-6725
ISSN:0020-1669
Container-title:Inorganic Chemistry
language:en
Short-container-title:Inorg. Chem.

Author:

Deeth Robert J.¹

Affiliation:

1. Inorganic Computational Chemistry Group, Department of Chemistry, University of Warwick, Coventry CV4 7AL, U.K.

Publisher

American Chemical Society (ACS)

Subject

Inorganic Chemistry,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ic800313s

Reference61 articles.

1. Computer-Aided Design (CAD) of Synzymes: Use of Molecular Mechanics (MM) for the Rational Design of Superoxide Dismutase Mimics

2. MM2 force field parameterisation, modelling and structure prediction of salen-type monomeric and hydrogen-bonded dimeric manganese complexes

3. Theoretical modeling of the mechanism of dioxygen activation and evolution by tetranuclear manganese complexes

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