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Python Protein MD Analysis tutorial

Published in WorkflowHub • Jan 1, 2022
NobleIDNI4P51W42R35S21
Authors:
Adam Hospital
,
Genís Bayarri

Abstract

# Protein MD Analysis tutorial using BioExcel Building Blocks (biobb) *** This workflow computes a set of Quality Control (QC) analyses on top of an uploaded MD trajectory. QC analyses include positional divergence (RMSd), change of shape (Radius of Gyration), identification of flexible regions (ato...

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