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Membrane permeability of small molecules from unbiased molecular dynamics simulations

The Journal of Chemical Physics(2020)10.1063/5.0013429Source: DataRank Database

Membrane permeability of small molecules from unbiased molecular dynamics simulations is a research paper published in The Journal of Chemical Physics (2020). On theSindex it has a DataRank of 0. It has been cited 71 times.

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0DataRank · unranked

Scored on demand from live citation data

Open Access71 citations

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datarank_citation_only_1hop_v6· scope data_onlyMethodology

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Enrichment:Funding (3 grants)Impact (FWCI 4.93)OA: bronzeTopics (24)IDs (PubMed, PMC, OpenAlex)Annotations (1)SDGs (1)

FAIR Checklist

Context only (not used in score)

Findable (1/2)

Has DOI

Accessible (1/2)

Open Access

Interoperable (0/2)

Reusable (0/3)

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Authors (7)

An Ghysels ORCID,Eric Wang ORCID,Richard M. Venable,Jeffery B. Klauda ORCID,Bernard R. Brooks ORCID

Live enrichment

PubMed:33003739 PMC:PMC7519415 OpenAlex:https://openalex.org/W3088264786

National Science Foundation

Grant: CBET-1604576

National Science Foundation

Grant: MCB-100139

National Heart, Lung, and Blood Institute

Grant: Intramural Research

FWCI

4.93

Citation Percentile

1.0%

Citation Trend

2020

2021

2022

2023

2024

2025

2026

bronzeLicense: https://publishing.aip.org/authors/rights-and-permissions

journalhttps://aip.scitation.org/doi/pdf/10.1063/5.0013429

publisherhttps://aip.scitation.org/doi/pdf/10.1063/5.0013429

publisherhttp://aip.scitation.org/doi/am-pdf/10.1063/5.0013429

publisherhttps://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/5.0013429/14754297/124107_1_online.pdf

journalhttps://doi.org/10.1063/5.0013429

Fields of Study

Spectroscopy and Quantum Chemical StudiesProtein Structure and DynamicsLipid Membrane Structure and Behavior

Keywords

Molecular dynamicsPermeationMicrosecondThermostatWater modelChemistryWork (physics)Monte Carlo methodChemical physicsPermeability (electromagnetism)Statistical physicsDiffusionMoleculeMembraneThermodynamicsBiological systemComputational chemistryPhysicsMathematicsStatisticsOrganic chemistry

Sustainable Development Goals

SDG 0: Clean water and sanitation