Discontinuous Molecular Dynamics Simulations of Biomolecule Interfacial Behavior: Study of Ovispirin-1 Adsorption on a Graphene Surface-Reference-Cited by-同舟云学术

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Discontinuous Molecular Dynamics Simulations of Biomolecule Interfacial Behavior: Study of Ovispirin-1 Adsorption on a Graphene Surface

Published:2021-02-15 Issue:3 Volume:17 Page:1874-1882
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Zheng Size¹^ORCID,Sajib Md Symon Jahan²,Wei Yong³,Wei Tao²^ORCID

Affiliation:

1. College of Materials and Chemistry & Chemical Engineering, Chengdu University of Technology, Chengdu, Sichuan 610059, P. R. China

2. Chemical Engineering Department, Howard University, Washington, D.C. 20059, United States

3. Department of Computer Science and Information Systems, University of North Georgia, Dahlonega, Georgia 30597, United States

Funder

Division of Chemical, Bioengineering, Environmental, and Transport Systems

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.0c01172

Reference85 articles.

1. Polymer-Based Marine Antifouling and Fouling Release Surfaces: Strategies for Synthesis and Modification

2. The Role of Hydrogen Bonding in Peptoid-Based Marine Antifouling Coatings

3. Ultralow-Fouling, Functionalizable, and Hydrolyzable Zwitterionic Materials and Their Derivatives for Biological Applications

4. Biocompatibility and biofouling of MEMS drug delivery devices

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1. Graphic contrastive learning analyses of discontinuous molecular dynamics simulations: Study of protein folding upon adsorption;Applied Physics Letters;2023-06-19

2. Mesoscopic simulations of protein corona formation on zwitterionic peptide-grafted gold nanoparticles;Journal of Nanoparticle Research;2023-05-19

3. Partial Denaturation of Double-Stranded DNA on Pristine Graphene under Physiological-like Conditions;Liquids;2023-03-30

4. Hydration and antibiofouling of TMAO-derived zwitterionic polymers surfaces studied with atomistic molecular dynamics simulations;Colloids and Surfaces A: Physicochemical and Engineering Aspects;2022-11

5. Characterizing protein–surface and protein–nanoparticle conjugates: Activity, binding, and structure;The Journal of Chemical Physics;2022-09-07

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