Molecular dynamics-based refinement and validation for sub-5 Å cryo-electron microscopy maps

Two structure determination methods, based on the molecular dynamics flexible fitting (MDFF) paradigm, are presented that resolve sub-5 Å cryo-electron microscopy (EM) maps with either single structures or ensembles of such structures. The methods, denoted cascade MDFF and resolution exchange MDFF,...

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Bibliographic Details
Published in:eLife
Main Authors: Abhishek Singharoy, Ivan Teo, Ryan McGreevy, John E Stone, Jianhua Zhao, Klaus Schulten
Format: Article
Language:English
Published: eLife Sciences Publications Ltd 2016-07-01
Subjects:
cryoelectron microscopy
high-resolution
cloud computing
hybrid methods
B-factors
flexible fitting
Online Access:https://elifesciences.org/articles/16105

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