Integrating AlphaFold pLDDT Scores into CABS-flex for enhanced protein flexibility simulations

Integrating AlphaFold pLDDT Scores into CABS-flex for enhanced protein flexibility simulations

CABS-flex is a well-established method for fast protein flexibility simulations, offering an effective balance between computational efficiency and accuracy in modeling protein dynamics. To further enhance its predictive capabilities, we propose incorporating AlphaFold's predicted Local Distanc...

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Bibliographic Details
Main Authors: Karol Wróblewski, Sebastian Kmiecik
Format: Article
Language:English
Published: Elsevier 2024-12-01
Series:Computational and Structural Biotechnology Journal
Subjects:
Structure-based model
Protein structure
Protein flexibility
Molecular dynamics
Online Access:http://www.sciencedirect.com/science/article/pii/S2001037024004185
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http://www.sciencedirect.com/science/article/pii/S2001037024004185

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