عنوان
پدید آورنده
موضوع
رده
کتابخانه
محل استقرار
NATIONAL BIBLIOGRAPHY NUMBER
Number
LA9mj8s5z4
TITLE AND STATEMENT OF RESPONSIBILITY
Title Proper
Recent Developments and Applications of the MMPBSA Method.
General Material Designation
[Article]
First Statement of Responsibility
Wang, ChanghaoGreene, D'ArtagnanXiao, LiQi, RuxiLuo, Ray
SUMMARY OR ABSTRACT
Text of Note
The Molecular Mechanics Poisson-Boltzmann Surface Area (MMPBSA) approach has been widely applied as an efficient and reliable free energy simulation method to model molecular recognition, such as for protein-ligand binding interactions. In this review, we focus on recent developments and applications of the MMPBSA method. The methodology review covers solvation terms, the entropy term, extensions to membrane proteins and high-speed screening, and new automation toolkits. Recent applications in various important biomedical and chemical fields are also reviewed. We conclude with a few future directions aimed at making MMPBSA a more robust and efficient method.
SET
Date of Publication
2017
Title
UC Irvine
ELECTRONIC LOCATION AND ACCESS
Electronic name
مطالعه متن کتاب [Article]
278226
a
Y
