Konstantinos Gkionis

Quantum Chemical Benchmark Study on 46 RNA Backbone Families Using a Dinucleotide Unit

Holger Kruse, Arnošt Mládek, Konstantinos Gkionis et al. · Journal of Chemical Theory and Computation · 2015 · 111 citations

Ion Binding to Quadruplex DNA Stems. Comparison of MM and QM Descriptions Reveals Sizable Polarization Effects Not Included in Contemporary Simulations

Konstantinos Gkionis, Holger Kruse, James A. Platts et al. · Journal of Chemical Theory and Computation · 2014 · 89 citations

Molecular Mechanical, Dna Analysis, Molecular Biology +18

NMR shielding as a probe of intermolecular interactions: ab initio and density functional theory studies

James A. Platts, Konstantinos Gkionis · Physical Chemistry Chemical Physics · 2009 · 50 citations

Magnetic Resonance, Chemical Shift, Computational Chemistry +17

Insights into DNA Binding of Ruthenium Arene Complexes: Role of Hydrogen Bonding and π Stacking

Konstantinos Gkionis, James A. Platts, J. Grant Hill · Inorganic Chemistry · 2008 · 37 citations

QM/MM description of platinum–DNA interactions: comparison of binding and DNA distortion of five drugs

Konstantinos Gkionis, Shaun T. Mutter, James A. Platts · RSC Advances · 2013 · 32 citations · Full text

Dna Analysis, Molecular Biology, Qm/mm Description +23