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Rapid and accurate estimation of protein–ligand relative binding affinities using site-identification by ligand competitive saturation

Chemical Science(2021)10.1039/d1sc01781kSource: DataRank Database

Rapid and accurate estimation of protein–ligand relative binding affinities using site-identification by ligand competitive saturation is a research paper published in Chemical Science (2021). On theSindex it has a DataRank of 0. It has been cited 51 times.

N/A

0DataRank · unranked

Scored on demand from live citation data

Open Access51 citations

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›Methodology & internals

datarank_citation_only_1hop_v6· scope data_onlyMethodology

Pipeline:MetadataData-paper checkEnrichmentCitation networkScoring

Enrichment:Funding (6 grants)OA: goldTopics (4)IDs (PubMed, PMC)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 (6)

Anthony Hazel ORCID,Vincent D. Ustach ORCID,Sunhwan Jo ORCID,Wenbo Yu ORCID,Alexander D. MacKerell ORCID

Live enrichment

PubMed:34257885 PMC:PMC8246086

Center for Scientific Review

Grant: R01GM131710

Center for Scientific Review

Grant: R44GM109635

NIGMS NIH HHS

Grant: R35 GM131710

National Institutes of Health

Grant: 5R44GM109635-05

Pre-computed free energy maps for rapid structure-based ligand design

National Institutes of Health

Grant: 5R35GM131710-02

Macromolecular Conformational Heterogeneity

Samuel Waxman Cancer Research Foundation

goldLicense: cc-by-nc

publisherhttps://pubs.rsc.org/en/content/articlepdf/2021/sc/d1sc01781k

publisherhttp://pubs.rsc.org/en/content/articlepdf/2021/SC/D1SC01781K

repositoryhttps://www.ncbi.nlm.nih.gov/pmc/articles/8246086

Europe_PMChttps://europepmc.org/articles/PMC8246086

Europe_PMChttps://europepmc.org/articles/PMC8246086?pdf=render

Fields of Study

0103 physical sciences01 natural sciences0104 chemical sciences

Keywords

Chemistry

Sustainable Development Goals

SDG 3: 3. Good health