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Fragment-Based Hit Discovery via Unsupervised Learning of Fragment-Protein Complexes

bioRxiv (Cold Spring Harbor Laboratory)(2022)10.1101/2022.11.21.517375Source: DataRank Database

Fragment-Based Hit Discovery via Unsupervised Learning of Fragment-Protein Complexes is a research paper published in bioRxiv (Cold Spring Harbor Laboratory) (2022). On theSindex it has a DataRank of 0. It has been cited 9 times.

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Open Access9 citations

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Enrichment:Funding (3 grants)OA: greenTopics (21)IDs (PubMed, OpenAlex)Annotations (1)SDGs (2)

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Open Access

Interoperable (0/2)

Reusable (0/3)

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Authors (9)

Ivan Ahel ORCID,Haim Barr ORCID,G.J. Correy ORCID,James S. Fraser ORCID,Nir London ORCID

Live enrichment

PubMed:30945415 OpenAlex:https://openalex.org/W4309923193

National Institutes of Health

Grant: 1U19AI171110-01

QCRG Pandemic Response Program

National Institutes of Health

Grant: 3P30GM133894-06S1

A Synchrotron Radiation Structural Biology Resource

National Science Foundation

Grant: 2031205

RAPID: Structural investigation of interactors of SARS CoV 2

greenLicense: cc-by

repositoryhttps://www.biorxiv.org/content/biorxiv/early/2022/11/24/2022.11.21.517375.full.pdf

GREENhttps://www.biorxiv.org/content/biorxiv/early/2022/11/24/2022.11.21.517375.full.pdf

repositoryhttps://www.biorxiv.org/content/biorxiv/early/2022/11/24/2022.11.21.517375.full.pdf

publisherhttps://syndication.highwire.org/content/doi/10.1101/2022.11.21.517375

repositoryhttps://doi.org/10.1101/2022.11.21.517375

Fields of Study

Computational Drug Discovery MethodsMicrobial Natural Products and BiosynthesisProtein Structure and DynamicsBiologyChemistryComputer Science0301 basic medicine03 medical and health sciences

Keywords

PharmacophoreFragment (logic)Drug discoveryComputer scienceComputational biologyUnsupervised learningSmall moleculeArtificial intelligenceChemistryStereochemistryBiologyAlgorithmBiochemistry

Sustainable Development Goals

SDG 3: 3. Good healthSDG 0: Quality Education

Fragment-Based Hit Discovery via Unsupervised Learning of Fragment-Protein Complexes

FAIR Checklist

Authors (9)

Funding (3 grants)

Open Access

Topics

Annotations (Europe PMC)