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Joint neutron/molecular dynamics vibrational spectroscopy reveals softening of HIV-1 protease upon binding of a tight inhibitor

Physical Chemistry Chemical Physics(2022)10.1039/d1cp05487bSource: DataRank Database

Joint neutron/molecular dynamics vibrational spectroscopy reveals softening of HIV-1 protease upon binding of a tight inhibitor is a research paper published in Physical Chemistry Chemical Physics (2022). On theSindex it has a DataRank of 0. It has been cited 4 times.

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0DataRank · unranked

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Open Access4 citations

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datarank_citation_only_1hop_v6· scope data_onlyMethodology

Pipeline:MetadataData-paper checkEnrichmentCitation networkScoring

Enrichment:Funding (4 grants)Impact (FWCI 0.22)OA: greenTopics (50)IDs (PubMed, PMC, OpenAlex)Annotations (1)SDGs (2)

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)

Oksana Gerlits ORCID,Luke L. Daemen,Ànna Pavlova ORCID,James C. Gumbart ORCID,Yongqiang Cheng ORCID

Live enrichment

PubMed:35089990 PMC:PMC8940534 OpenAlex:https://openalex.org/W4206907085

National Institutes of Health

Grant: R01-AI148740

National Science Foundation

Grant: grant ACI-1548562

NIAID NIH HHS

Grant: R01 AI148740

National Institutes of Health

Grant: 1R01AI148740-01A1

Altering Hepatitis B Virus assembly through pharmacological intervention

FWCI

0.22

Citation Percentile

0.4%

Citation Trend

2022

2026

greenLicense: http://rsc.li/journals-terms-of-use#chorus

repositoryhttps://www.osti.gov/biblio/1844872

publisherhttp://pubs.rsc.org/en/content/articlepdf/2022/CP/D1CP05487B

journalhttps://doi.org/10.1039/d1cp05487b

repositoryhttps://pubmed.ncbi.nlm.nih.gov/35089990

Fields of Study

Enzyme Structure and FunctionRNA and protein synthesis mechanismsProtein Structure and Dynamics0301 basic medicine0303 health sciences03 medical and health sciencesHIV ProteaseHIV-1Molecular Dynamics SimulationNeutronsSpectrum AnalysisVibration

MeSH Terms

NeutronsSpectrum AnalysisVibrationHIV-1HIV ProteaseMolecular Dynamics Simulation

Keywords

DarunavirSofteningInelastic neutron scatteringNeutron spectroscopyMolecular physicsMolecular dynamicsBinding energyDynamics (music)Tight bindingChemistryNeutron scatteringQuasielastic neutron scatteringInelastic scatteringSpectroscopyAtomic physicsNeutronChemical physicsMaterials sciencePhysicsHuman immunodeficiency virus (HIV)Computational chemistryScatteringNuclear physicsElectronic structureVirologyOpticsNeutronsHIV ProteaseSpectrum AnalysisHIV-1Molecular Dynamics SimulationVibration

Sustainable Development Goals

SDG 3: 3. Good healthSDG 0: Good health and well-being