Work

Polarizability rescaling and atom-based Thole scaling in the CHARMM Drude polarizable force field for ethers

Year: 2009

Type: article

Source: Journal of Molecular Modeling

DOI: 10.1007/s00894-009-0572-4

Authors: Christopher M. Baker, Alexander D. MacKerell

Institution: University of Maryland, Baltimore

Language: English

Topic: Advanced Chemical Physics Studies

Subfield: Atomic and Molecular Physics, and Optics

Field: Physics and Astronomy

Domain: Physical Sciences

Open Access status: green

Funders: National Institutes of Health, National Institute of General Medical Sciences

Awards: G1046122180, Oligonucleotide Conformational Heterogeneity, G4635912206, HALOGEN FREE ENERGY DATABASE FOR RATIONAL DRUG DESIGN, Carbohydrate force fields for structure, dynamics and molecular recognition

OpenAlex ID: W2046136961

FWCI: 2.783

Cites: 40

Cited by: 70

Related to: 10