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CMDmpnn: Combining Comparative Molecular Dynamics and ProteinMPNN to Rapidly Expand Enzyme Substrate Spectrum

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Year: 2025
Type: article
Source: Journal of Chemical Information and Modeling
DOI: 10.1021/acs.jcim.5c00117
Authors: Chuan-qi Sun, Zhi-min Li, Yu Ji, Ulrich Schwaneberg, Zong-lin Li
Institutions: East China University of Science and Technology, State Key Laboratory of Bioreactor Engineering, Beijing University of Chemical Technology, RWTH Aachen University
Language: English

Topic: Protein Structure and Dynamics
Subfield: Molecular Biology
Field: Biochemistry, Genetics and Molecular Biology
Domain: Life Sciences

Open Access status: closed

Funder: National Key Research and Development Program of China
Award: G8216062491
OpenAlex ID: W4408330488
FWCI: 1.015
Cites: 22
Cited by: 4
Related to: 10
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