Comparison of Methods to Obtain Force-Field Parameters for Metal Sites-Reference-Cited by-同舟云学术

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Comparison of Methods to Obtain Force-Field Parameters for Metal Sites

Published:2011-07-20 Issue:8 Volume:7 Page:2452-2463
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Hu LiHong¹²,Ryde Ulf²

Affiliation:

1. School of Computer Science and Information Technology, North-east Normal University, Changchun, 130024, Peopleʼs Republic of China

2. Department of Theoretical Chemistry, Lund University, Chemical Centre, Post Office Box 124, SE-221 00 Lund, Sweden

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct100725a

Reference76 articles.

1. Molecular mechanics: theoretical basis, rules, scope and limits

2. [11] Model building and refinement practice

3. Approaches to the Description and Prediction of the Binding Affinity of Small-Molecule Ligands to Macromolecular Receptors

4. Molecular Modeling of Matter: Impact and Prospects in Engineering

5. Force Fields for Protein Simulations

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