Combined Locally Enhanced Sampling and Particle Mesh Ewald as a Strategy To Locate the Experimental Structure of a Nonhelical Nucleic Acid

1998 ◽  
Vol 120 (29) ◽  
pp. 7149-7155 ◽  
Author(s):  
Carlos Simmerling ◽  
Jennifer L. Miller ◽  
Peter A. Kollman
Keyword(s):  
Nucleic Acid ◽  
Enhanced Sampling ◽  
Particle Mesh Ewald ◽  
Locally Enhanced Sampling ◽  
Experimental Structure

Mutational Locally Enhanced Sampling (MULES) for quantitative prediction of the effects of mutations at protein–protein interfaces

2012 ◽  
Vol 3 (5) ◽  
pp. 1503 ◽  
Author(s):  
Richard T. Bradshaw ◽  
Pietro G. A. Aronica ◽  
Edward W. Tate ◽  
Robin J. Leatherbarrow ◽  
Ian R. Gould
Keyword(s):  
Quantitative Prediction ◽  
Enhanced Sampling ◽  
Protein Interfaces ◽  
Locally Enhanced Sampling

scholarly journals 2P128 Structure analysis of DNA mini hairpin using locally enhanced sampling method

2005 ◽  
Vol 45 (supplement) ◽  
pp. S151
Author(s):  
S. Yamasaki ◽  
S. Nakamura ◽  
T. Terada ◽  
K. Shimizu
Keyword(s):  
Structure Analysis ◽  
Sampling Method ◽  
Enhanced Sampling ◽  
Locally Enhanced Sampling
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