Tushar van der Wijst

Performance of various density functionals for the hydrogen bonds in DNA base pairs

Tushar van der Wijst, Célia Fonseca Guerra, Marcel Swart et al. · Chemical Physics Letters · 2006 · 156 citations

Natural Sciences, Biophysics, Chemistry +16

π-π stacking tackled with density functional theory

Marcel Swart, Tushar van der Wijst, Célia Fonseca Guerra et al. · Journal of Molecular Modeling · 2007 · 142 citations · Full text

Natural Sciences, Chemistry, Computational Chemistry +14

Catalytic Site Prediction and Virtual Screening of Cytochrome P450 2D6 Substrates by Consideration of Water and Rescoring in Automated Docking

Chris de Graaf, Chris Oostenbrink, Peter H. J. Keizers et al. · Journal of Medicinal Chemistry · 2006 · 129 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +16

Adenine versus guanine quartets in aqueous solution: dispersion-corrected DFT study on the differences in π-stacking and hydrogen-bonding behavior

Célia Fonseca Guerra, Tushar van der Wijst, Jordi Poater et al. · Theoretical Chemistry Accounts · 2009 · 128 citations · Full text

Natural Sciences, Chemistry, Computational Chemistry +16

A Ditopic Ion‐Pair Receptor Based on Stacked Nucleobase Quartets

Tushar van der Wijst, Célia Fonseca Guerra, Marcel Swart et al. · Angewandte Chemie International Edition · 2009 · 74 citations

Pharmacy, Medicinal Chemistry, Molecular Biophysics +16