List of works - Jan Novotný

Biocompatible Xanthine-Quadruplex Scaffold for Ion-Transporting DNA Channels.

scientific article published on 21 June 2012

Designing a New Class of Bases for Nucleic Acid Quadruplexes and Quadruplex-Active Ligands.

scientific article published in June 2015

Electron-Spin Structure and Metal–Ligand Bonding in Open-Shell Systems from Relativistic EPR and NMR: A Case Study of Square-Planar Iridium Catalysts

scientific article published on 14 December 2018

Exploring non-covalent interactions in guanine- and xanthine-based model DNA quadruplex structures: a comprehensive quantum chemical approach

scientific article published in 2014

Hyperfine Effects in Ligand NMR: Paramagnetic Ru(III) Complexes with 3-Substituted Pyridines.

scientific article published on 29 November 2017

Interplay of Through-Bond Hyperfine and Substituent Effects on the NMR Chemical Shifts in Ru(III) Complexes

scientific article published on 13 July 2018

Interpreting the Paramagnetic NMR Spectra of Potential Ru(III) Metallodrugs: Synergy between Experiment and Relativistic DFT Calculations

scientific article published on 05 July 2016

Linking the Character of the Metal-Ligand Bond to the Ligand NMR Shielding in Transition-Metal Complexes: NMR Contributions from Spin-Orbit Coupling.

scientific article published on 6 July 2017

Lone-pair-π interactions: analysis of the physical origin and biological implications.

scientific article published in July 2016

Nucleic Acid Quadruplexes Based on 8-Halo-9-deazaxanthines: Energetics and Noncovalent Interactions in Quadruplex Stems

article

Nucleotides containing variously modified sugars: energetics, structure, and mechanical properties.

scientific article published on 16 December 2015

Relativistic Heavy-Neighbor-Atom Effects on NMR Shifts: Concepts and Trends Across the Periodic Table

scientific article published on 23 June 2020

Structure, solvent, and relativistic effects on the NMR chemical shifts in square-planar transition-metal complexes: assessment of DFT approaches.

scientific article published on 7 September 2015

Substituting CF2for O4′ in Components of Nucleic Acids: Towards Systems with Reduced Propensity to Form Abasic Lesions

article

Supramolecular Covalence in Bifurcated Chalcogen Bonding

scientific article published on 14 March 2017

Tailoring the properties of quadruplex nucleobases for biological and nanomaterial applications

scientific article published on 01 August 2014

Through-Space Paramagnetic NMR Effects in Host-Guest Complexes: Potential Ruthenium(III) Metallodrugs with Macrocyclic Carriers.

scientific article published on 5 April 2018

Toward Reproducing Sequence Trends in Phosphorus Chemical Shifts for Nucleic Acids by MD/DFT Calculations

scientific article

Weak Supramolecular Interactions Governing Parallel and Antiparallel DNA Quadruplexes: Insights from Large-Scale Quantum Mechanics Analysis of Experimentally Derived Models

scientific article published on 22 February 2017

Zwitterionic Ru(III) Complexes: Stability of Metal-Ligand Bond and Host-Guest Binding with Cucurbit[7]uril

scientific article published on 07 July 2020

List of works by Jan Novotný