Borys Szefczyk
Wrocław University of Science and Technology(PL)University of Wrocław(PL)
Publications by Year
Research Areas
Enzyme Structure and Function, Ionic liquids properties and applications, Mesoporous Materials and Catalysis, Protein Structure and Dynamics, Retinal Development and Disorders
Most-Cited Works
- → Differential Transition-State Stabilization in Enzyme Catalysis: Quantum Chemical Analysis of Interactions in the Chorismate Mutase Reaction and Prediction of the Optimal Catalytic Field(2004)111 cited
- → Transition state stabilization and substrate strain in enzyme catalysis: ab initio QM/MM modelling of the chorismate mutase reaction(2004)106 cited
- → Insights into enzyme catalysis from QM/MM modelling: transition state stabilization in chorismate mutase(2003)81 cited
- → Optimal methods for calculation of the amount of intermolecular electron transfer(2002)57 cited
- → Structure of Alkylimidazolium-Based Ionic Liquids at the Interface with Vacuum and Water—A Molecular Dynamics Study(2015)43 cited
- → Physical Properties at the Base for the Development of an All-Atom Force Field for Ethylene Glycol(2011)42 cited
- → Structure of the hexagonal NaYF4 phase from first-principles molecular dynamics(2014)35 cited
- → Geometries and Vertical Excitation Energies in Retinal Analogues Resolved at the CASPT2 Level of Theory: Critical Assessment of the Performance of CASSCF, CC2, and DFT Methods(2013)28 cited
- → Quantum chemical analysis of reaction paths in chorismate mutase: Conformational effects and electrostatic stabilization(2007)24 cited
- → Molecular Dynamics Study of Hydrated Poly(ethylene oxide) Chains Grafted on Siloxane Surface(2011)21 cited