Accelerated Molecular Dynamics for Peptide Folding: Benchmarking Different Combinations of Force Fields and Explicit Solvent Models-Reference-Cited by-同舟云学术

Accelerated Molecular Dynamics for Peptide Folding: Benchmarking Different Combinations of Force Fields and Explicit Solvent Models

Published:2023-05-10 Issue:10 Volume:63 Page:3030-3042
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Coppa Crescenzo¹^ORCID,Bazzoli Andrea¹^ORCID,Barkhordari Maral¹,Contini Alessandro¹^ORCID

Affiliation:

1. Dipartimento di Scienze Farmaceutiche − Sezione di Chimica Generale e Organica “Alessandro Marchesini”, Università degli Studi di Milano, Via Venezian, 21, 20133 Milano, Italy

Funder

Universit? degli Studi di Milano

H2020 Marie Sklodowska-Curie Actions

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.3c00138

Reference66 articles.

1. Principles of protein-protein interactions.

2. Protein–protein interactions: detection, reliability assessment and applications

3. Protein-Protein Interaction Detection: Methods and Analysis

4. In silico Approaches for the Design and Optimization of Interfering Peptides Against Protein–Protein Interactions

5. Protein-Protein Interaction Tools

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