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个人简介
Areas of scientific activity
1 Theoretical calculations for molecules and their interactions. Modelling of intermolecular interactions of the molecular complexes. Special attention is paid to many-body nonadditive forces and the spectroscopic parameters of the interacting systems.
2 Theoretical study of the water clusters, finding their structure and understanding their IR and NMR spectra.
3 Ozon destruction problem - Solvation and ionization stages of HCl on ice nanoparticels.
4 Intermolecular effects in NMR chemical shifts and NMR spin-spin coupling constants studied with quantum-chemical calculations. NMR spin-spin coupling constants transmitted through hydrogen bonds.
5 Dihydrogen bonding – spectroscopic parameters and the nature of interaction
6 Vibrational circular dichroizm (VCD) spectra of interacting molecules. Transfer of chirality.
7 Relativistic effects for NMR for noble-gas compounds.
8 Fentanyl and its derivatives – interactions with opioid and sigma1 receptors.
研究兴趣
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Paulina Maczugowska, Paulina Zawadzka,Krzysztof Halagan,Marcin Pastorczak,Joanna Sadlej,Marcin Kozanecki
JOURNAL OF MOLECULAR LIQUIDS (2023): 121580-121580
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Treatments, Mechanisms, and Adverse Reactions of Anesthetics and Analgesicspp.89-100, (2022)
Michał Filip Rode,Joanna Sadlej, Małgorzata M. Szczęśniak, Andrzej L. Sobolewski, M. F. Rode, A. L. Sobolewski, J. Jankowska
semanticscholar(2019)
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Journal of Molecular Modelingno. 5 (2019)
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MOLECULAR SPECTROSCOPY: A QUANTUM CHEMISTRY APPROACH, VOLS 1 AND 2pp.171-198, (2019)
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