Computer Simulation of Biomolecular Systems
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Published By Springer Netherlands

9789048185283, 9789401711203
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Application of Poisson—Boltzmann solvation forces to macromolecular simulations

1997 ◽  
pp. 244-261 ◽  
Author(s):  
Adrian H. Elcock ◽  
Michael J. Potter ◽  
J. Andrew McCammon
Keyword(s):  
Poisson Boltzmann ◽  
Solvation Forces

Semi-explicit bag model for protein solvation

1997 ◽  
pp. 223-243 ◽  
Author(s):  
Richard C. Brower ◽  
S. Roy Kimura
Keyword(s):  
Bag Model

Gaussian shape methods

1997 ◽  
pp. 150-176 ◽  
Author(s):  
J. A. Grant ◽  
B. T. Pickup
Keyword(s):  
Gaussian Shape

Estimation of binding affinity in structure-based design

1997 ◽  
pp. 466-493
Author(s):  
Dave Timms ◽  
Anthony J. Wilkinson
Keyword(s):  
Binding Affinity

Empirical classical interaction functions for molecular simulation

1997 ◽  
pp. 3-82 ◽  
Author(s):  
P. H. Hünenberger ◽  
W. F. van Gunsteren
Keyword(s):  
Molecular Simulation

Reduced variable molecular dynamics

1997 ◽  
pp. 122-149 ◽  
Author(s):  
James Turner ◽  
Paul K. Weiner ◽  
Barry Robson ◽  
Ravi Venugopal ◽  
Harry Schubele ◽  
...  
Keyword(s):  
Molecular Dynamics

A separating framework for increasing the timestep in molecular dynamics

1997 ◽  
pp. 97-121 ◽  
Author(s):  
Eric Barth ◽  
Margaret Mandziuk ◽  
Tamar Schlick
Keyword(s):  
Molecular Dynamics
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