Classes
- Quantum Theory of MoleculesNBCM039 | Faculty of Mathematics and Physics
- Practical Exercises in Quantum Theory of Molecules INBCM099 | Faculty of Mathematics and Physics
- 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
- Seminar on Theoretical Chemical PhysicsNBCM046 | 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
- 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
- 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
- Hydration Process as an Activation of Trans- and Cisplatin Complexes in Anticancer Treatment. DFT and Ab Initio Computational Study of Thermodynamic and Kinetic Parameter2005 | Faculty of Mathematics and Physics, Central Library of Charles University
- Theoretical description of copper Cu (I)/Cu (II) complexes in mixed ammine-aqua environment. DFT and ab initio quantum chemical study2005 | Faculty of Mathematics and Physics, Central Library of Charles University
- Study of Electronic Spectra of Free-Base Porphin and Mg-Porphin: Comprehensive Comparison of Variety of Ab Initio, DFT, and Semiempirical Methods2005 | Faculty of Mathematics and Physics, Central Library of Charles University
- Activation barriers and rate constans for hydration of platinum and palladium square-planar complexes: An ab initio study2004 | Faculty of Mathematics and Physics, Central Library of Charles University
- Theoretical model of cooper Cu(I)/Cu(II) hydration. DFT and ab initio quantum chemical study2004 | Faculty of Mathematics and Physics
- Deformations of the DNA helix: the influence of cisplatin as revealed by ab initio study of platinum(II) bridged DNA purine bases2003 | Faculty of Mathematics and Physics
- A Systematic ab Initio Study of the Hydration of Selected Palladium Square-Planar Complexes. A Comparison with Platinum Analogues2001 | Faculty of Mathematics and Physics, Central Library of Charles University
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