Molecular dynamics simulations of bacterial outer membrane lipid extraction: Adequate sampling?-Reference-Cited by-同舟云学术

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Molecular dynamics simulations of bacterial outer membrane lipid extraction: Adequate sampling?

Published:2020-07-28 Issue:4 Volume:153 Page:044122
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:J. Chem. Phys.

Author:

Shearer Jonathan¹^ORCID,Marzinek Jan K.²^ORCID,Bond Peter J.²³^ORCID,Khalid Syma¹^ORCID

Affiliation:

1. School of Chemistry, University of Southampton, Highfield, Southampton SO17 1BJ, United Kingdom

2. Bioinformatics Institute (BII), Agency for Science, Technology and Research (A*STAR), 30 Biopolis Street, Matrix #07-01, 138671, Singapore

3. Department of Biological Sciences, National University of Singapore, 14 Science Drive 4, Singapore 117543, Singapore

Funder

National Research Foundation Singapore

Engineering and Physical Sciences Research Council

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/5.0017734

Reference49 articles.

1. Lipid–Protein Interactions Are Unique Fingerprints for Membrane Proteins

2. Lipid Clustering Correlates with Membrane Curvature as Revealed by Molecular Simulations of Complex Lipid Bilayers

3. Role of O-Antigen in Response to Mechanical Stress of the E. coli Outer Membrane: Insights from Coarse-Grained MD Simulations

4. It Is Complicated: Curvature, Diffusion, and Lipid Sorting within the Two Membranes of Escherichia coli

5. Dynamics and Interactions of OmpF and LPS: Influence on Pore Accessibility and Ion Permeability

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