Aligning Experimental and Theoretical Anisotropic B-Factors: Water Models, Normal-Mode Analysis Methods, and Metrics
Author:
Affiliation:
1. Department of Physiology and Biophysics, School of Medicine, Virginia Commonwealth University, Richmond, Virginia 23298, United States
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp4124327
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3. Berendsen, H. J. C.Simulating the Physical World: Hierarchical Modeling from Quantum Mechanics to Fluid Dynamics;Cambridge University Press:Cambridge, U.K., 2007; pxxvii.
4. Lubich, C.From Quantum to Classical Molecular Dynamics: Reduced Models and Numerical Analysis;European Mathematical Society:Zärich, Switzerland, 2008; pix.
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