Classes
- Practical Exercises in Quantum Theory of Molecules IINBCM116 | Faculty of Mathematics and Physics
- Ab Initio Methods and Density Functional Theory INBCM121 | Faculty of Mathematics and Physics
- Ab Initio Methods and Density Functional Theory IINBCM122 | Faculty of Mathematics and Physics
- Quantum Theory of MoleculesNBCM039 | Faculty of Mathematics and Physics
- Seminar on Theoretical Chemical PhysicsNBCM046 | Faculty of Mathematics and Physics
- Practical Exercises in Quantum Theory of Molecules INBCM099 | Faculty of Mathematics and Physics
- Computational Experiments in Molecular Theory IINBCM125 | Faculty of Mathematics and Physics
- Theoretical seminar of biophysics and chemical physicsNBCM180 | Faculty of Mathematics and Physics
- General ChemistryNBCM183 | Faculty of Mathematics and Physics
Publications
- Structure and stability of kaolinite/TiO2 nanocomposite: DFT and MM computations2012 | Faculty of Mathematics and Physics
- Computational study of short-range interactions in bacteriochlorophyll aggregates2012 | Faculty of Mathematics and Physics
- Reactions of cisplatin and glycine in solution with constant pH: a computational study2012 | Faculty of Mathematics and Physics
- Binding of piano-stool Ru(II) complexes to DNA; QM/MM study2012 | Faculty of Mathematics and Physics
- Exploring the Potential Energy Surface for the Interaction of Sterically Hindered Trichloro(diethylenetriamine)gold(III) Complexes with Water2012 | Faculty of Mathematics and Physics
- Comparison of hydration reactions for "piano-stool" RAPTA-B and [Ru(eta(6) - arene)(en)Cl](+) complexes: Density functional theory computational study2011 | Faculty of Mathematics and Physics
- Activation of the cisplatin and transplatin complexes in solution with constant pH and concentration of chloride anions; quantum chemical study2011 | Faculty of Mathematics and Physics
- Cisplatin Interaction with Amino Acids Cysteine and Methionine from Gas Phase to Solutions with Constant pH2010 | Faculty of Mathematics and Physics
- The Influence of a sugar-phosphate backbone on the cisplatin-bridged BpB´ models of DNA purine bases. Quantum chemical calculations of Pt(II) bonding characteristics2004 | Faculty of Mathematics and Physics
- The (XH)2 Species (X=F through At) in the Groups of the Periodic System: MP2 and CCSD(T) Ab initio Quantum Chemical Calculations1998 | Faculty of Mathematics and Physics
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