We are delighted to welcome Dr Lubomír Rulíšek to the RSC Advances team this month!
Lubomír Rulíšek is a Senior Research Group Leader at the Institute of Organic Chemistry and Biochemistry of the Czech Academy of Sciences, Prague (IOCB). He completed his master’s degrees at the Charles University, Prague and obtained his Ph.D. at IOCB in 2001 (supervised by Dr. Zdeněk Havlas). He was a postdoctoral research fellow at Lund University, Sweden, with Prof. Ulf Ryde who introduced him into theoretical bioinorganic chemistry which has been one of his favorite research themes since then. In addition, the research in the Rulíšek group encompasses various applications of quantum chemistry and quantum and molecular mechanical (QM/MM) modelling: physico-chemical principles of protein structures, protein–ligand interactions, computational electrochemistry, theoretical spectroscopy, organic reactivity, computational homogeneous catalysis, and biomolecular design. He is a true believer in indispensable and integral role of computations in contemporary chemical and biological research.
Rulíšek says, “I am grateful for the opportunity to join RSC Advances as an associate editor and look forward to serve to a large community of chemists and biologists”.
Browse a selection of Lubomír’s RSC publications:
Conformational Energies and Equilibria of Cyclic Dinucleotides In Vacuo and In Solution: Computational Chemistry vs. NMR Experiments
Gutten, O., Jurečka, P., Aliakbar Tehrani, Z., Budešínský, M., Řezáč, J., Rulíšek, L.
Phys. Chem. Chem. Phys. 2021, Accepted Manuscript
DOI: 10.1039/D0CP05993E
Solvatochromic fluorene-linked nucleoside and DNA as color-changing fluorescent probes for sensing interactions
Dmytro Dziuba, Petr Pospíšil, Ján Matyašovský, Jiří Brynda, Dana Nachtigallová, Lubomír Rulíšek, Radek Pohl, Martin Hof and Michal Hocek
Chem. Sci., 2016, 7, 5775-5785
DOI: 10.1039/C6SC02548J
The non-planarity of the benzene molecule in the X-ray structure of the chelated bismuth(iii) heteroboroxine complex is not supported by quantum mechanical calculations
Jindřich Fanfrlík, Robert Sedlak, Adam Pecina, Lubomír Rulíšek, Libor Dostál, Ján Moncóľ, Aleš Růžička and Pavel Hobza
Dalton Trans., 2016, 45, 462-465
DOI: 10.1039/C5DT04381F
How simple is too simple? Computational perspective on importance of second-shell environment for metal-ion selectivity
Ondrej Gutten and Lubomír Rulíšek
Phys. Chem. Chem. Phys., 2015, 17, 14393-14404
DOI: 10.1039/C4CP04876H
A new insight into the zinc-dependent DNA-cleavage by the colicin E7 nuclease: a crystallographic and computational study
Anikó Czene, Eszter Tóth, Eszter Németh, Harm Otten, Jens-Christian N. Poulsen, Hans E. M. Christensen, Lubomír Rulíšek, Kyosuke Nagata, Sine Larsen and Béla Gyurcsik
Metallomics, 2014, 6, 2090-2099
DOI: 10.1039/C4MT00195H
Theoretical calculations of physico-chemical and spectroscopic properties of bioinorganic systems: current limits and perspectives
Tibor András Rokob, Martin Srnec and Lubomír Rulíšek
Dalton Trans., 2012, 41, 5754-5768
DOI: 10.1039/C2DT12423H
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