Binding-and-Folding Recognition of an Intrinsically Disordered Protein Using Online Learning Molecular Dynamics-Reference-Cited by-同舟云学术

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Binding-and-Folding Recognition of an Intrinsically Disordered Protein Using Online Learning Molecular Dynamics

Published:2023-06-21 Issue:13 Volume:19 Page:3817-3824
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Herrera-Nieto Pablo¹^ORCID,Pérez Adrià¹²^ORCID,De Fabritiis Gianni¹³⁴^ORCID

Affiliation:

1. Computational Science Laboratory, Universitat Pompeu Fabra, Barcelona Biomedical Research Park (PRBB), C Dr. Aiguader 88, 08003, Barcelona, Spain

2. Acellera Labs, C Dr Trueta 183, 08005, Barcelona, Spain

3. Acellera Ltd, Devonshire House 582, Stanmore Middlesex, HA7 1JS, United Kingdom

4. Institució Catalana de Recerca i Estudis Avançats (ICREA), Passeig Lluis Companys 23, 08010 Barcelona, Spain

Funder

European Regional Development Fund

Ministerio de Economía y Competitividad

H2020 Research Infrastructures

Acellera

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c00008

Reference45 articles.

1. Intrinsically unstructured proteins and their functions

2. Structure of the MDM2 Oncoprotein Bound to the p53 Tumor Suppressor Transactivation Domain

3. Solution Structure of the KIX Domain of CBP Bound to the Transactivation Domain of c-Myb

4. Complete reconstruction of an enzyme-inhibitor binding process by molecular dynamics simulations

5. Complete protein–protein association kinetics in atomic detail revealed by molecular dynamics simulations and Markov modelling

Cited by 2 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Dynamics and interactions of intrinsically disordered proteins;Current Opinion in Structural Biology;2024-02

2. MYB: A Key Transcription Factor in the Hematopoietic System Subject to Many Levels of Control;Advances in Experimental Medicine and Biology;2024

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