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Profil
| Derzeitige Stellung | Professor W-1 und Äquivalente |
|---|---|
| Fachgebiet | Biophysikalische Chemie,Theoretische Chemie: Elektronenstruktur, Dynamik, Simulation |
| Keywords | protein folding, molecular dynamics, nucleic acids, halogen bond, computer-aided drug design |
Aktuelle Kontaktadresse
| Land | Tschechische Republik |
|---|---|
| Ort | Prague 6 |
| Universität/Institution | University of Chemistry and Technology Prague |
| Institut/Abteilung | Department of Physical Chemistry |
Gastgeber*innen während der Förderung
| Prof. Dr. Paolo Carloni | Institute for Advanced Simulation (IAS), Forschungszentrum Jülich GmbH, Jülich |
|---|---|
| Beginn der ersten Förderung | 01.01.2014 |
Publikationen (Auswahl)
| 2017 | Michal H. Kolá?, Oriana Tabarrini: Halogen Bonding in Nucleic Acid Complexes. In: The Journal of Medicinal Chemistry, 2017, 8681-8690 |
|---|---|
| 2015 | Michal H. Kolář, Palanisamy Deepa, Haresh Ajani, Adam Pecina, Pavel Hobza: Characteristics of a σ-Hole and the Nature of a Halogen Bond. In: Pierangelo Mentragolo, Giuseppe Resnati, Halogen Bonding II. Springer International Publishing, 2015. 1-25 |
| 2015 | Robert Sedlak, Michal H. Kolář, Pavel Hobza: Polar Flattening and the Strength of Halogen Bonding. In: The Journal of Chemical Theory and Computation, 2015, 4727-4732 |
| 2015 | Jindrich Fanfrlik, Francesc X. Ruiz, Aneta Kadlčíková, Jan Řezáč, Alexandra Cousido-Siah, André Mitschler, Susanta Haldar, Martin Lepsik, Michal H. Kolář, Pavel Majer, Alberto D. Podjarny, Pavel Hobza: The Effect of Halogen-to-Hydrogen Bond Substitution on Human Aldose Reductase Inhibition. In: ACS Chemical Biology, 2015, 1637-1642 |
| 2014 | Michal H. Kolář, Paolo Carloni, Pavel Hobza: Statistical analysis of σ-holes: a novel complementary view on halogen bonding. In: Physical Chemistry Chemical Physics, 2014, 19111-19116 |
| 2014 | Michal Kolář, Jiří Hosta, Pavel Hobza: The strength and directionality of a halogen bond are co-determined by the magnitude and size of the σ-hole. In: Physical Chemistry Chemical Physics, 2014, 9987-9996 |