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	1.	Accurate Intermolecular Interaction Energies from a Combination of MP2 and TDDFT Response Theory. [electronic resource] by Pitoňák, Michal Heßelmann, Andreas Producer: 20151201 In: Journal of chemical theory and computation vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Spin-component scaled coupled-clusters singles and doubles optimized towards calculation of noncovalent interactions. [electronic resource] by Pitonák, Michal Rezác, Jan Hobza, Pavel Producer: 20101221 In: Physical chemistry chemical physics : PCCP vol. 12 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	C-H stretching vibrational shift of benzene dimer: consistency of experiment and calculation. [electronic resource] by Wang, Weizhou Pitonák, Michal Hobza, Pavel Producer: 20080102 In: Chemphyschem : a European journal of chemical physics and physical chemistry vol. 8 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Accuracy of Several Wave Function and Density Functional Theory Methods for Description of Noncovalent Interaction of Saturated and Unsaturated Hydrocarbon Dimers. [electronic resource] by Granatier, Jaroslav Pitoňák, Michal Hobza, Pavel Producer: 20151124 In: Journal of chemical theory and computation vol. 8 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	Perception of neighborhood environment and health risk behaviors in Prague's teenagers: a pilot study in a post-communist city. [electronic resource] by Spilkova, Jana Dzúrova, Dagmar Pitonak, Michal Producer: 20150417 In: International journal of health geographics vol. 13 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	A Transferable H-Bonding Correction for Semiempirical Quantum-Chemical Methods. [electronic resource] by Korth, Martin Pitoňák, Michal Řezáč, Jan Hobza, Pavel Producer: 20151201 In: Journal of chemical theory and computation vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	Highly accurate CCSD(T) and DFT-SAPT stabilization energies of H-bonded and stacked structures of the uracil dimer. [electronic resource] by Pitonák, Michal Riley, Kevin E Neogrády, Pavel Hobza, Pavel Producer: 20081017 In: Chemphyschem : a European journal of chemical physics and physical chemistry vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	Comparative Study of Selected Wave Function and Density Functional Methods for Noncovalent Interaction Energy Calculations Using the Extended S22 Data Set. [electronic resource] by Gráfová, Lucie Pitoňák, Michal Řezáč, Jan Hobza, Pavel Producer: 20151201 In: Journal of chemical theory and computation vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	Stabilization and structure calculations for noncovalent interactions in extended molecular systems based on wave function and density functional theories. [electronic resource] by Riley, Kevin E Pitonák, Michal Jurecka, Petr Hobza, Pavel Producer: 20101222 In: Chemical reviews vol. 110 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	On the Structure and Geometry of Biomolecular Binding Motifs (Hydrogen-Bonding, Stacking, X-H···π): WFT and DFT Calculations. [electronic resource] by Riley, Kevin E Pitoňák, Michal Černý, Jiří Hobza, Pavel Producer: 20151201 In: Journal of chemical theory and computation vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	Complete Basis Set Extrapolation and Hybrid Schemes for Geometry Gradients of Noncovalent Complexes. [electronic resource] by Černý, Jiří Pitoňák, Michal Riley, Kevin E Hobza, Pavel Producer: 20151125 In: Journal of chemical theory and computation vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	On the Structure and Geometry of Biomolecular Binding Motifs (Hydrogen-Bonding, Stacking, X-H···π): WFT and DFT Calculations. [electronic resource] by Riley, Kevin E Pitoňák, Michal Cerný, Jiřı Hobza, Pavel Producer: 20160329 In: Journal of chemical theory and computation vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	Off-Center Gaussian Functions, an Alternative Atomic Orbital Basis Set for Accurate Noncovalent Interaction Calculations of Large Systems. [electronic resource] by Melicherčík, Miroslav Pitoňák, Michal Kellö, Vladimír Hobza, Pavel Neogrády, Pavel Producer: 20151222 In: Journal of chemical theory and computation vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	Toward more efficient CCSD(T) calculations of intermolecular interactions in model hydrogen-bonded and stacked dimers. [electronic resource] by Dedíková, Pavlína Pitonák, Michal Neogrády, Pavel Cernusák, Ivan Urban, Miroslav Producer: 20080924 In: The journal of physical chemistry. A vol. 112 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	Scaled MP3 non-covalent interaction energies agree closely with accurate CCSD(T) benchmark data. [electronic resource] by Pitonák, Michal Neogrády, Pavel Cerný, Jirí Grimme, Stefan Hobza, Pavel Producer: 20090306 In: Chemphyschem : a European journal of chemical physics and physical chemistry vol. 10 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Benchmark database on isolated small peptides containing an aromatic side chain: comparison between wave function and density functional theory methods and empirical force field. [electronic resource] by Valdes, Haydee Pluhácková, Kristýna Pitonák, Michal Rezác, Jan Hobza, Pavel Producer: 20080805 In: Physical chemistry chemical physics : PCCP vol. 10 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	17.	Caesium hydride: MS-CASPT2 potential energy curves and A [electronic resource] by Škoviera, Ján Neogrády, Pavel Louis, Florent Pitoňák, Michal Černušák, Ivan Producer: 20180608 In: The Journal of chemical physics vol. 146 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	18.	HIV epidemic among men who have sex with men in the Czech Republic, 2016: high time for targeted action. [electronic resource] by Mravčík, Viktor Pitoňák, Michal Hejzák, Robert Janíková, Barbara Procházka, Ivo Producer: 20180416 In: Euro surveillance : bulletin Europeen sur les maladies transmissibles = European communicable disease bulletin vol. 22 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	19.	MP2.5 and MP2.X: approaching CCSD(T) quality description of noncovalent interaction at the cost of a single CCSD iteration. [electronic resource] by Sedlak, Robert Riley, Kevin E Řezáč, Jan Pitoňák, Michal Hobza, Pavel Producer: 20130826 In: Chemphyschem : a European journal of chemical physics and physical chemistry vol. 14 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	20.	The accuracy of quantum chemical methods for large noncovalent complexes. [electronic resource] by Sedlak, Robert Janowski, Tomasz Pitoňák, Michal Rezáč, Jan Pulay, Peter Hobza, Pavel Publication details: Journal of chemical theory and computation Aug 2013 In: Journal of chemical theory and computation vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)

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Your search returned 24 results.