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Journal of Molecular Modeling|April 26, 2019
Reaction mechanism between Cu(II)-enolate complex and O2 as a test case for methodology used in DFT computational studiesAgnieszka Stańczak, Anna Miłaczewska, Tomasz Borowski
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 9, 2022
Comprehensive Theoretical View of the [Cu2 O2 ] Side-on-Peroxo-/Bis-μ-Oxo EquilibriaAgnieszka Stańczak, Jakub Chalupský, Lubomír Rulíšek, et al.
Biomolecules|November 15, 2018
Exploring Solanum tuberosum Epoxide Hydrolase Internal Architecture by Water Molecules TrackingKarolina Mitusińska, Tomasz Magdziarz, Maria Bzówka, et al.
Molecules (Basel, Switzerland)|June 13, 2020
Bioengineering of Cytochrome P450 OleTJE: How Does Substrate Positioning Affect the Product Distributions?Fabián G Cantú Reinhard, Yen-Ting Lin, Agnieszka Stańczak, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|October 5, 2019
Can a Mononuclear Iron(III)-Superoxo Active Site Catalyze the Decarboxylation of Dodecanoic Acid in UndA to Produce Biofuels?Yen-Ting Lin, Agnieszka Stańczak, Yulian Manchev, et al.
Coordination Chemistry Reviews|September 2, 2025
Coupled Binuclear Copper Sites in Biology: An Experimentally-Calibrated Computational PerspectiveAgnieszka Stańczak, Ioannis Kipouros, Petr Eminger, et al.
Proceedings of the National Academy of Sciences of the United States of America|August 8, 2022
Elucidation of the tyrosinase/O2/monophenol ternary intermediate that dictates the monooxygenation mechanism in melanin biosynthesisIoannis Kipouros, Agnieszka Stańczak, Jake W Ginsbach, et al.
Bioinformatics (Oxford, England)|December 21, 2019
AQUA-DUCT 1.0: structural and functional analysis of macromolecules from an intramolecular voids perspectiveTomasz Magdziarz, Karolina Mitusińska, Maria Bzówka, et al.
Chemical Communications (Cambridge, England)|March 3, 2022
Evidence for H-bonding interactions to the μ-η2:η2-peroxide of oxy-tyrosinase that activate its coupled binuclear copper siteIoannis Kipouros, Agnieszka Stańczak, Martin Culka, et al.
Plos One|February 24, 2023
Transient binding sites at the surface of haloalkane dehalogenase LinB as locations for fine-tuning enzymatic activityAgata Raczyńska, Patryk Kapica, Katarzyna Papaj, et al.
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