Quantitative computer simulations of biomolecules: A snapshot-Reference-Cited by-同舟云学术

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Quantitative computer simulations of biomolecules: A snapshot

Published:2007-08-20 Issue:4 Volume:29 Page:668-672
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J. Comput. Chem.

Author:

Yang Wei,Nymeyer Hugh,Zhou Huan-Xiang,Berg Bernd,Brüschweiler Rafael

Funder

FSU School of Computational Science (SCS)

Institute of Molecular Biophysics (IMB)

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Reference70 articles.

1. Importance of the CMAP Correction to the CHARMM22 Protein Force Field: Dynamics of Hen Lysozyme

2. Comparison of multiple Amber force fields and development of improved protein backbone parameters

3. Empirical force fields for biological macromolecules: Overview and issues

4. Model-free approach to the interpretation of nuclear magnetic resonance relaxation in macromolecules. 1. Theory and range of validity

5. Molecular Dynamics and NMR Spin Relaxation in Proteins

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2. Predictive Sampling of Rare Conformational Events in Aqueous Solution: Designing a Generalized Orthogonal Space Tempering Method;Journal of Chemical Theory and Computation;2015-12-04

3. Motions and Entropies in Proteins as Seen in NMR Relaxation Experiments and Molecular Dynamics Simulations;The Journal of Physical Chemistry B;2014-10-28

4. Practically Efficient and Robust Free Energy Calculations: Double-Integration Orthogonal Space Tempering;Journal of Chemical Theory and Computation;2012-02-14

5. Generalized essential energy space random walks to more effectively accelerate solute sampling in aqueous environment;The Journal of Chemical Physics;2012-01-28

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