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poly(tetramethylene succinate-co-tetramethylene adipate)

Known as: PBSA 
 
National Institutes of Health

Papers overview

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Review
2019
Review
2019
Molecular mechanics Poisson-Boltzmann surface area (MM/PBSA) and molecular mechanics generalized Born surface area (MM/GBSA) are… Expand
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Highly Cited
2016
Highly Cited
2016
Understanding protein-protein interactions (PPIs) is quite important to elucidate crucial biological processes and even design… Expand
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Highly Cited
2014
Highly Cited
2014
By using different evaluation strategies, we systemically evaluated the performance of Molecular Mechanics/Generalized Born… Expand
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Highly Cited
2013
Highly Cited
2013
Here, we systematically investigated how the force fields and the partial charge models for ligands affect the ranking… Expand
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Highly Cited
2012
Highly Cited
2012
MM-PBSA is a post-processing end-state method to calculate free energies of molecules in solution. MMPBSA.py is a program written… Expand
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Highly Cited
2011
Highly Cited
2011
The Molecular Mechanics/Poisson-Boltzmann Surface Area (MM/PBSA) and the Molecular Mechanics/Generalized Born Surface Area (MM… Expand
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Highly Cited
2010
Highly Cited
2010
In the drug discovery process, accurate methods of computing the affinity of small molecules with a biological target are… Expand
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Highly Cited
2009
Highly Cited
2009
Methods for protein modeling and design advanced rapidly in recent years. At the heart of these computational methods is an… Expand
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Highly Cited
2001
Highly Cited
2001
In this work, a new ansatz is presented that combines molecular dynamics simulations with MM-PBSA (Molecular Mechanics Poisson… Expand
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Highly Cited
2000
Highly Cited
2000
Dimerization of HIV-I protease (HIV PR) monomers is an essential prerequisite for viral proteolytic activity and the subsequent… Expand
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