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List of works by Michał Rostkowski

A New Interpretation of Chlorine Leaving Group Kinetic Isotope Effects; A Theoretical Approach

scientific article published on 01 July 2004

A Theoretical Investigation of α-Carbon Kinetic Isotope Effects and Their Relationship to the Transition-State Structure of SN2 Reactions

scientific article published on 01 May 2005

Analysis of Conformer Stability for 1,3,8-Trihydroxynaphthalene: Natural Substrate of Fungal Trihydroxynaphthalene Reductase

scientific article published on 23 June 2007

Can Path Integral Molecular Dynamics Make a Good Approximation for Vapor Pressure Isotope Effects Prediction for Organic Solvents? A Comparison to ONIOM QM/MM and QM Cluster Calculation

scientific article published on 16 July 2018

Decomposition of Piloty's acid derivatives - Toward the understanding of factors controlling HNO release

scientific article published on 15 November 2018

Enzyme mechanisms from molecular modeling and isotope effects.

scientific article published on 24 January 2008

Graphical analysis of pH-dependent properties of proteins predicted using PROPKA.

scientific article

Improved Treatment of Ligands and Coupling Effects in Empirical Calculation and Rationalization of pKa Values.

scientific article published on 9 June 2011

Influence of the solvent description on the predicted mechanism of SN2 reactions.

scientific article

Mechanistic Analysis of the Base-Catalyzed HF Elimination from 4-Fluoro-4-(4′-nitrophenyl)butane-2-one Based on Liquid-Phase Kinetic Isotope Effects Calculated by Dynamics Modeling with Multidimensional Tunneling†

PIN3 duplication may be partially responsible for TP53 haploinsufficiency

scientific article

The contribution of atom accessibility to site of metabolism models for cytochromes P450.

scientific article published on 22 January 2013

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