Aug 10, 2023 · A key property of effective antibiotics against Gram-negative bacteria is their ability to permeate through the bacterial outer membrane via ...
Mar 27, 2023 · Molecular dynamics (MD) simulations are in principle capable of modeling antibiotic permeation across outer membrane porins (OMPs). However, ...
Aug 10, 2023 · Molecular dynamics (MD) simulations are, in principle, capable of modeling antibiotic permeation across outer membrane porins (OMPs). However, ...
Apr 24, 2024 · OprO, reaching PMFs converged to sub-kilocalorie per mole accuracy. ... teria by the presence of an outer membrane and of a thinner peptidoglycan ...
Aug 10, 2023 · Converging PMF Calculations of Antibiotic Permeation across an Outer Membrane Porin with Subkilocalorie per Mole Accuracy.
Converging PMF calculations of antibiotic permeation across an outer membrane porin with sub-kilocalorie per mole accuracy. https://doi.org/10.1101/2023.03 ...
Mar 27, 2023 · Converging PMF calculations of antibiotic permeation across an outer membrane porin with sub-kilocalorie per mole accuracy · bioRxiv ...
Mar 28, 2023 · Converging PMF calculations of antibiotic permeation across an outer membrane porin with sub-kilocalorie per mole accuracy ...
Aug 16, 2023 · This work done in my former group compared MD simulation techniques in quantifying the permeation of fosmidomycin antibiotic across the OprO ...
Jeremy Lapierre. PhD student. Latest. Converging PMF Calculations of Antibiotic Permeation across an Outer Membrane Porin with Subkilocalorie per Mole ...