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Protein WISDOM: A Workbench for In silico De novo Design of BioMolecules
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A preorganization oriented computational method for de novo design of Kemp elimination enzymes

Shengyu Zhang1, Jun Zhang2, Wenjia Luo3

  • 1College of Life Science and Technology, Beijing University of Chemical Technology, Beijing 100029, China; Department of Chemical Engineering, Tsinghua University, Beijing 100084, China.

Enzyme and Microbial Technology
|July 11, 2022
PubMed

Keywords:
Artificial enzymeComputational enzyme designKemp eliminationMolecular dynamics simulationProtein structure predictionQuantum mechanics calculation

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