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Structural and electronic analysis of the octarepeat region of prion protein with four Cu 2+ by polarizable MD and QM/MM simulations

Physical Chemistry Chemical Physics(2021)10.1039/d1cp03187bSource: DataRank Database

Structural and electronic analysis of the octarepeat region of prion protein with four Cu 2+ by polarizable MD and QM/MM simulations is a research paper published in Physical Chemistry Chemical Physics (2021). On theSindex it has a DataRank of 0. It has been cited 4 times.

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Open Access4 citations

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datarank_citation_only_1hop_v6· scope data_onlyMethodology

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Enrichment:Funding (3 grants)Impact (FWCI 0.32)OA: greenTopics (30)IDs (PubMed, PMC, OpenAlex)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 (4)

Liliana Quintanar ORCID,Alberto Vela ORCID,G. Andrés Cisneros ORCID,Jorge Nochebuena ORCID

Live enrichment

PubMed:34550129 PMC:PMC8497436 OpenAlex:https://openalex.org/W3200770367

National Science Foundation

Grant: CHE-1531468

National Science Foundation

Grant: NSF-CHEM/CLP 1856162

National Institutes of Health

Grant: R01GM108583

FWCI

0.32

Citation Percentile

0.6%

Citation Trend

2021

2022

2024

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

repositoryhttps://www.ncbi.nlm.nih.gov/pmc/articles/8497436

publisherhttp://pubs.rsc.org/en/content/articlepdf/2021/CP/D1CP03187B

journalhttps://doi.org/10.1039/d1cp03187b

repositoryhttps://pubmed.ncbi.nlm.nih.gov/34550129

Fields of Study

Prion Diseases and Protein MisfoldingTrace Elements in HealthCoordination ComplexesCopperDensity Functional TheoryElectronsMolecular ConformationMolecular Dynamics SimulationPrion Proteins

MeSH Terms

Prion ProteinsDensity Functional TheoryCopperElectronsMolecular ConformationMolecular Dynamics SimulationCoordination Complexes

Keywords

Molecular dynamicsPolarizabilityIonChemistryCopperChemical physicsCrystallographyElectron paramagnetic resonanceMetal ions in aqueous solutionMoleculeComputational chemistryPhysicsNuclear magnetic resonanceOrganic chemistry

Sustainable Development Goals

SDG 0: Life in Land