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Rationalizing perhydrolase activity of aryl-esterase and subtilisin Carlsberg mutants by molecular dynamics simulations of the second tetrahedral intermediate state
| Title: | Rationalizing perhydrolase activity of aryl-esterase and subtilisin Carlsberg mutants by molecular dynamics simulations of the second tetrahedral intermediate state | Authors: | Lee, Wook; Vojcic, Ljubica; Despotović, Dragana   ; Prodanović, Radivoje ; Maurer, Karl-Heinz; Schwaneberg, Ulrich; Zacharias, Martin |
Issue Date: | 2010 | Publication: | Theoretical Chemistry Accounts | ISSN: | 1432-881X Theoretical Chemistry Accounts Search Idenfier |
Publisher: | New York : Springer | Type: | Article | Collation: | vol. 125 br. 3-6 str. 375-386 | DOI: | 10.1007/s00214-009-0611-3 | WoS-ID: | 000273363300024 | Scopus-ID: | 2-s2.0-77949262410 | URI: | https://cherry.chem.bg.ac.rs/handle/123456789/1039 https://enauka.gov.rs/handle/123456789/474185 |
Project: | CLAMV (Computer Laboratories for Animation, Modeling and Visualization) at Jacobs University Bremen EMSL (Environmental Molecular Science Laboratories) at the PNNL (Pacific Northwest National Laboratories) |
M-category: | 21M21 |
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