Published May 22, 2023 | Version 1.0.0
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Catalytic Rules and Validation Results for "EzMechanism: An Automated Tool to Propose Catalytic Mechanisms of Enzyme Reactions"

Description

Dataset containing the "Rules of Enzyme Catalysis" as created during the development of EzMechanism and the validation results of the software. For more information see https://www.biorxiv.org/content/10.1101/2022.09.05.506575v1, and the M-CSA website in https://www.ebi.ac.uk/thornton-srv/m-csa/

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Files (302.6 MB)

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md5:e2bae3f7bc88395bc7d546175581a91a
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md5:7c0bb8ef60f7a51bd6c2c77b7c5bc68c
302.0 MB Download

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Related works

Is supplement to
Preprint: https://www.biorxiv.org/content/10.1101/2022.09.05.506575v1 (URL)