A combined semiempirical and DFT computational protocol for studying bioorganometallic complexes: Application to molybdocene-cysteine complexes-Reference-Cited by-同舟云学术

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A combined semiempirical and DFT computational protocol for studying bioorganometallic complexes: Application to molybdocene-cysteine complexes

Published:2013-12-02 Issue:4 Volume:35 Page:324-334
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Suárez Dimas¹,Díaz Natalia¹,López Ramón¹

Affiliation:

1. Departamento de Química Física y Analítica; Facultad de Química; Universidad de Oviedo; C/ Julián Clavería 8 Oviedo 33006 Spain

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/jcc.23503/fullpdf

Reference43 articles.

1. Asymmetric Catalysis: Science and Opportunities (Nobel Lecture) Copyright© The Nobel Foundation 2002. We thank the Nobel Foundation, Stockholm, for permission to print this lecture.

2. Olefin-Metathesis Catalysts for the Preparation of Molecules and Materials (Nobel Lecture)

3. Multiple Metal–Carbon Bonds for Catalytic Metathesis Reactions (Nobel Lecture)

4. Application of Metal Coordination Chemistry To Explore and Manipulate Cell Biology

5. Organometallic Compounds: An Opportunity for Chemical Biology?

Cited by 3 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. 16OSTM10: a new open-shell transition metal conformational energy database to challenge contemporary semiempirical and force field methods;Physical Chemistry Chemical Physics;2022

2. Application of Semiempirical Methods to Transition Metal Complexes: Fast Results but Hard-to-Predict Accuracy;Journal of Chemical Theory and Computation;2018-05-22

3. Molecular Modeling of Bioorganometallic Compounds: Thermodynamic Properties of Molybdocene-Glutathione Complexes and Mechanism of Peptide Hydrolysis;ChemPhysChem;2015-04-14

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