SNP2SIM: a modular workflow for standardizing molecular simulation and functional analysis of protein variants

SNP2SIM: a modular workflow for standardizing molecular simulation and functional analysis of protein variants

Abstract Background Molecular simulations are used to provide insight into protein structure and dynamics, and have the potential to provide important context when predicting the impact of sequence variation on protein function. In addition to understanding molecular mechanisms and interactions on t...

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Bibliographic Details
Main Authors: Matthew D. McCoy, Vikram Shivakumar, Sridhar Nimmagadda, Mohsin Saleet Jafri, Subha Madhavan
Format: Article
Language:English
Published: BMC 2019-04-01
Series:BMC Bioinformatics
Subjects:
Molecular dynamics
Ligand docking
Protein structure
Functional prediction
Online Access:http://link.springer.com/article/10.1186/s12859-019-2774-9

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http://link.springer.com/article/10.1186/s12859-019-2774-9

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