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Journal Abstract Search

278 related items for PubMed ID: 30134730

  • 21. Lipid Composition Is Critical for Accurate Membrane Permeability Prediction of Cyclic Peptides by Molecular Dynamics Simulations.
    Sugita M, Fujie T, Yanagisawa K, Ohue M, Akiyama Y.
    J Chem Inf Model; 2022 Sep 26; 62(18):4549-4560. PubMed ID: 36053061
    [Abstract] [Full Text] [Related]

  • 22. Assessing the Intestinal Permeability of Small Molecule Drugs via Diffusion Motion on a Multidimensional Free Energy Surface.
    Shoji A, Kang C, Fujioka K, Rose JP, Sun R.
    J Chem Theory Comput; 2022 Jan 11; 18(1):503-515. PubMed ID: 34851637
    [Abstract] [Full Text] [Related]

  • 23. In silico study of levodopa in hydrated lipid bilayers at the atomistic level.
    Megariotis G, Romanos N, Avramopoulos A, Mikaelian G, Theodorou DN.
    J Mol Graph Model; 2021 Sep 11; 107():107972. PubMed ID: 34174554
    [Abstract] [Full Text] [Related]

  • 24. Molecular simulation of nonfacilitated membrane permeation.
    Awoonor-Williams E, Rowley CN.
    Biochim Biophys Acta; 2016 Jul 11; 1858(7 Pt B):1672-87. PubMed ID: 26706099
    [Abstract] [Full Text] [Related]

  • 25. Thermodynamic analysis of protegrin-1 insertion and permeation through a lipid bilayer.
    Vivcharuk V, Kaznessis YN.
    J Phys Chem B; 2011 Dec 15; 115(49):14704-12. PubMed ID: 22044268
    [Abstract] [Full Text] [Related]

  • 26. Development of structure-lipid bilayer permeability relationships for peptide-like small organic molecules.
    Cao Y, Xiang TX, Anderson BD.
    Mol Pharm; 2008 Dec 15; 5(3):371-88. PubMed ID: 18355031
    [Abstract] [Full Text] [Related]

  • 27. Calculation of the permeability coefficients of small molecules through lipid bilayers by free-energy reaction network analysis following the explicit treatment of the internal conformation of the solute.
    Mitsuta Y, Asada T, Shigeta Y.
    Phys Chem Chem Phys; 2022 Nov 02; 24(42):26070-26082. PubMed ID: 36268802
    [Abstract] [Full Text] [Related]

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  • 29. Permeation Rates of Oxygen through a Lipid Bilayer Using Replica Exchange Transition Interface Sampling.
    Riccardi E, Krämer A, van Erp TS, Ghysels A.
    J Phys Chem B; 2021 Jan 14; 125(1):193-201. PubMed ID: 33369435
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  • 31. A Permeability Study of O2 and the Trace Amine p-Tyramine through Model Phosphatidylcholine Bilayers.
    Holland BW, Berry MD, Gray CG, Tomberli B.
    PLoS One; 2015 Jan 14; 10(6):e0122468. PubMed ID: 26086933
    [Abstract] [Full Text] [Related]

  • 32. Flip-flop of oleic acid in a phospholipid membrane: rate and mechanism.
    Wei C, Pohorille A.
    J Phys Chem B; 2014 Nov 13; 118(45):12919-26. PubMed ID: 25319959
    [Abstract] [Full Text] [Related]

  • 33. Permeability of acetic acid across gel and liquid-crystalline lipid bilayers conforms to free-surface-area theory.
    Xiang TX, Anderson BD.
    Biophys J; 1997 Jan 13; 72(1):223-37. PubMed ID: 8994607
    [Abstract] [Full Text] [Related]

  • 34. Quantitative Assessment of Methods Used To Obtain Rate Constants from Molecular Dynamics Simulations-Translocation of Cholesterol across Lipid Bilayers.
    Filipe HAL, Javanainen M, Salvador A, Galvão AM, Vattulainen I, Loura LMS, Moreno MJ.
    J Chem Theory Comput; 2018 Jul 10; 14(7):3840-3848. PubMed ID: 29864284
    [Abstract] [Full Text] [Related]

  • 35. Physics-Based Method for Modeling Passive Membrane Permeability and Translocation Pathways of Bioactive Molecules.
    Lomize AL, Pogozheva ID.
    J Chem Inf Model; 2019 Jul 22; 59(7):3198-3213. PubMed ID: 31259555
    [Abstract] [Full Text] [Related]

  • 36. Drude Polarizable Force Field for Molecular Dynamics Simulations of Saturated and Unsaturated Zwitterionic Lipids.
    Li H, Chowdhary J, Huang L, He X, MacKerell AD, Roux B.
    J Chem Theory Comput; 2017 Sep 12; 13(9):4535-4552. PubMed ID: 28731702
    [Abstract] [Full Text] [Related]

  • 37. Is the cholesterol bilayer domain a barrier to oxygen transport into the eye lens?
    Plesnar E, Szczelina R, Subczynski WK, Pasenkiewicz-Gierula M.
    Biochim Biophys Acta Biomembr; 2018 Feb 12; 1860(2):434-441. PubMed ID: 29079282
    [Abstract] [Full Text] [Related]

  • 38. Calcein release behavior from liposomal bilayer; influence of physicochemical/mechanical/structural properties of lipids.
    Maherani B, Arab-Tehrany E, Kheirolomoom A, Geny D, Linder M.
    Biochimie; 2013 Nov 12; 95(11):2018-33. PubMed ID: 23871914
    [Abstract] [Full Text] [Related]

  • 39. Permeability across lipid membranes.
    Shinoda W.
    Biochim Biophys Acta; 2016 Oct 12; 1858(10):2254-2265. PubMed ID: 27085977
    [Abstract] [Full Text] [Related]

  • 40. Permeability of small molecules through a lipid bilayer: a multiscale simulation study.
    Orsi M, Sanderson WE, Essex JW.
    J Phys Chem B; 2009 Sep 03; 113(35):12019-29. PubMed ID: 19663489
    [Abstract] [Full Text] [Related]

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