Judit Katalin Szántó (Katalin J Szántó)

Publication Activity (10 Years)

Years Active: 2022-2024
Publications (10 Years): 6

Top Topics

Molecular Dynamics Simulations

Binding Protein

Cross Sectional

Top Venues

Journal of chemical theory and computation

Journal of computational chemistry

This page only lists publications with an associated author ORCID identifier.

Publications

Judit Katalin Szántó, Johannes C B Dietschreit, Mikhail Shein, Anne Kathrin Schütz, Christian Ochsenfeld
Systematic QM/MM Study for Predicting 31 P NMR Chemical Shifts of Adenosine Nucleotides in Solution and Stages of ATP Hydrolysis in a Protein Environment. Journal of chemical theory and computation 20 (6) (2024)
Judit Katalin Szántó, Johannes C B Dietschreit, Mikhail Shein, Anne Kathrin Schütz, Christian Ochsenfeld
Systematic QM/MM Study for Predicting 31 P NMR Chemical Shifts of Adenosine Nucleotides in Solution and Stages of ATP Hydrolysis in a Protein Environment. Journal of chemical theory and computation (2024)
Judit Katalin Szántó, Johannes C B Dietschreit, Mikhail Shein, Anne Kathrin Schütz, Christian Ochsenfeld
Systematic QM/MM Study for Predicting 31 P NMR Chemical Shifts of Adenosine Nucleotides in Solution and Stages of ATP Hydrolysis in a Protein Environment. Journal of chemical theory and computation 20 (6) (2024)
Judit Katalin Szántó, Johannes C B Dietschreit, Mikhail Shein, Anne Kathrin Schütz, Christian Ochsenfeld
Systematic QM/MM Study for Predicting 31 P NMR Chemical Shifts of Adenosine Nucleotides in Solution and Stages of ATP Hydrolysis in a Protein Environment. Journal of chemical theory and computation 20 (6) (2024)
Judit Katalin Szántó, Johannes C B Dietschreit, Mikhail Shein, Anne Kathrin Schütz, Christian Ochsenfeld
Systematic QM/MM Study for Predicting 31 P NMR Chemical Shifts of Adenosine Nucleotides in Solution and Stages of ATP Hydrolysis in a Protein Environment. Journal of chemical theory and computation 20 (6) (2024)
Bónis Barcza, Ádám B Szirmai, Judit Katalin Szántó, Attila Tajti, Péter G Szalay
Comparison of approximate intermolecular potentials for ab initio fragment calculations on medium sized N-heterocycles. Journal of computational chemistry 43 (16) (2022)