Virtual protein engineering towards improved biocatalysts

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In-person class cancellation and work-from-home / Annulation des cours en pr茅sentiel et t茅l茅travail. McGILL ALERT! Due to freezing rain all in-person classes and activities on Wednesday, March 11, will be cancelled. Staff are asked not to come to campus tomorrow unless they are required on site by their supervisor to perform necessary functions and activities. See your 91丝瓜视频 email for more information.
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Virtual protein engineering towards improved biocatalysts

Published: 9 January 2016

As part of a new venture in the Moitessier research group, recent Ph.D graduate, Josh Pottel, has delved into developing software to guide protein engineering. Computers can be used to simulate the shape and function of a protein or enzyme, but need the correct tools to be able to create accurate models. An initial platform for generating and applying new side-chain (rotamer) libraries has shown promise as the foundation for a biocatalysis prediction software. The findings are developments were recently .

Reference: Joshua Pottel and Nicolas Moitessier* J. Chem. Inf. Model., 2015, 55 (12), 2657鈥�2671DOI: 10.1021/acs.jcim.5b00525