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How well do semiempirical QM methods describe the structure of proteins?

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Year: 2023
Type: article
Source: The Journal of Chemical Physics
DOI: 10.1063/5.0135091
Authors: J. Řezáč, J. J. P. Stewart
Institutions: Czech Academy of Sciences, Czech Academy of Sciences, Institute of Organic Chemistry and Biochemistry
Language: English

Topic: Advanced Chemical Physics Studies
Subfield: Atomic and Molecular Physics, and Optics
Field: Physics and Astronomy
Domain: Physical Sciences

Open Access status: closed

Funder: Grantová Agentura České Republiky
Award: Data-driven approach to the development of next-generation semiempirical QM methods
OpenAlex ID: W4315478990
FWCI: 2.086
Cites: 37
Cited by: 18
Related to: 10
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