Lipopolysaccharide Simulations Are Sensitive to Phosphate Charge and Ion Parameterization-Reference-Cited by-同舟云学术

Lipopolysaccharide Simulations Are Sensitive to Phosphate Charge and Ion Parameterization

Published:2020-02-05 Issue:3 Volume:16 Page:1806-1815
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Rice Amy¹,Rooney Mary T.²,Greenwood Alexander I.²³,Cotten Myriam L.²^ORCID,Wereszczynski Jeff¹^ORCID

Affiliation:

1. Department of Physics and Center for Molecular Study of Condensed Soft Matter, Illinois Institute of Technology, Chicago, Illinois 60616, United States

2. Department of Applied Science, College of William and Mary, Williamsburg, Virginia 23185, United States

3. Department of Physics, College of William and Mary, Williamsburg, Virginia 23185, United States

Funder

National Institute of General Medical Sciences

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.9b00868

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1. Outer membrane permeability and antibiotic resistance

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3. Antibiotic Resistance and Regulation of the Gram-Negative Bacterial Outer Membrane Barrier by Host Innate Immune Molecules

4. Molecular Basis of Bacterial Outer Membrane Permeability Revisited

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