CHRAMM-GUI MDFF/xMDFF Utilizer for Molecular Dynamics Flexible Fitting Simulations in Various Environments

X-ray crystallography and cryo-electron microscopy are two popular methods for the structure determination of biological molecules. Atomic structures are derived through the fitting and refinement of an initial model into electron density maps constructed by both experiments. Two computational appro...

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Bibliographic Details
Published in:J Phys Chem B
Main Authors: Qi, Yifei, Lee, Jumin, Singharoy, Abhishek, Mcgreevy, Ryan, Schulten, Klaus, Im, Wonpil
Format: Artigo
Language:Inglês
Published: 2016
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Article
Online Access:https://ncbi.nlm.nih.gov/pmc/articles/PMC5398930/
https://ncbi.nlm.nih.gov/pubmed/27936734
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcb.6b10568
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