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Trends in Biochemical Sciences|June 8, 2025
Unraveling the relationship between PET surfaces and their hydrolasesMarie Sofie Møller, Anton Bleckert, Anna Jäckering, et al.Journal of Chemical Information and Modeling|September 30, 2024
Influence of Wobbling Tryptophan and Mutations on PET Degradation Explored by QM/MM Free Energy CalculationsAnna Jäckering, Marc van der Kamp, Birgit Strodel, et al.Data in Brief|April 15, 2021
Dataset of AMBER force field parameters of drugs, natural products and steroids for simulations using GROMACSJennifer Loschwitz, Anna Jäckering, Monika Keutmann, et al.JACS Au|November 1, 2024
From Bulk to Binding: Decoding the Entry of PET into Hydrolase Binding PocketsAnna Jäckering, Frederike Göttsch, Moritz Schäffler, et al.Bioorganic Chemistry|April 16, 2021
Novel inhibitors of the main protease enzyme of SARS-CoV-2 identified via molecular dynamics simulation-guided in vitro assayJennifer Loschwitz, Anna Jäckering, Monika Keutmann, et al.ACS Catalysis|August 15, 2022
Multiple Substrate Binding Mode-Guided Engineering of a Thermophilic PET HydrolaseLara Pfaff, Jian Gao, Zhishuai Li, et al.Pageof 1