T. Hobza : rechercher sur Z-Library

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1

What about men? Social comparison and the effects of media images on body and self-esteem.

Hobza, Cody L., Walker, Karen E., Yakushko, Oksana, Peugh, James L.

Journal:

Psychology of Men and Masculinity

Année:

2007

Langue:

english

Fichier:

PDF, 397 KB

english, 2007

2

Functionalization of Graphene: Covalent and Non-Covalent Approaches, Derivatives and Applications

Georgakilas, Vasilios, Otyepka, Michal, Bourlinos, Athanasios B., Chandra, Vimlesh, Kim, Namdong, Kemp, K. Christian, Hobza, Pavel, Zboril, Radek, Kim, Kwang S.

Journal:

Chemical Reviews

Année:

2012

Langue:

english

Fichier:

PDF, 3.97 MB

english, 2012

3

Small area estimation under random regression coefficient models

Hobza, Tomáš, Morales, Domingo

Journal:

Journal of Statistical Computation and Simulation

Année:

2013

Langue:

english

Fichier:

PDF, 376 KB

english, 2013

4

A Wald-type test statistic based on robust modified median estimator in logistic regression models

Hobza, Tomáš, Martín, Nirian, Pardo, Leandro

Journal:

Journal of Statistical Computation and Simulation

Année:

2017

Langue:

english

Fichier:

PDF, 2.28 MB

english, 2017

5

Robust median estimator in logistic regression

T. Hobza, L. Pardo, I. Vajda

Journal:

Journal of Statistical Planning and Inference

Année:

2008

Langue:

english

Fichier:

PDF, 329 KB

english, 2008

6

Polar isomer of formic acid dimers formed in helium nanodroplets

Madeja, Frank, Havenith, Martina, Nauta, Klaas, Miller, Roger E., Chocholoušová, Jana, Hobza, Pavel

Journal:

The Journal of Chemical Physics

Année:

2004

Langue:

english

Fichier:

PDF, 471 KB

english, 2004

7

Benchmark database of accurate (MP2 and CCSD(T) complete basis set limit) interaction energies of small model complexes, DNA base pairs, and amino acid pairs

Jure?ka, Petr, ?poner, Ji??, ?ern?, Ji??, Hobza, Pavel

Journal:

Physical Chemistry Chemical Physics

Année:

2006

Langue:

english

Fichier:

PDF, 168 KB

english, 2006

8

Calculations on Noncovalent Interactions and Databases of Benchmark Interaction Energies

Journal:

Accounts of Chemical Research

Année:

2012

Langue:

english

Fichier:

PDF, 1.24 MB

english, 2012

9

Noncovalent Interactions: A Challenge for Experiment and Theory

Müller-Dethlefs, Klaus, Hobza, Pavel

Journal:

Chemical Reviews

Année:

2000

Langue:

english

Fichier:

PDF, 359 KB

english, 2000

10

Blue-Shifting Hydrogen Bonds

Hobza, Pavel, Havlas, Zdeněk

Journal:

Chemical Reviews

Année:

2000

Langue:

english

Fichier:

PDF, 155 KB

english, 2000

11

On the Nature of Bonding in Lone Pair···π-Electron Complexes: CCSD(T)/Complete Basis Set Limit Calculations

Ran, Jiong, Hobza, Pavel

Journal:

Journal of Chemical Theory and Computation

Année:

2009

Langue:

english

Fichier:

PDF, 153 KB

english, 2009

12

The Mathematics behind Lifesaving Kidney Exchange Programs

Sedlák, Róbert, Fanfrlík, Jindřich, Hnyk, Drahomír, Hobza, Pavel, Lepšík, Martin

Journal:

Année:

2010

Langue:

english

Fichier:

PDF, 849 KB

english, 2010

13

Introduction: Noncovalent Interactions

Hobza, Pavel, Řezáč, Jan

Journal:

Chemical Reviews

Année:

2016

Langue:

english

Fichier:

PDF, 1.44 MB

english, 2016

14

Genomic imprinting mediates dosage compensation in a young plant XY system

Muyle, Aline, Zemp, Niklaus, Fruchard, Cécile, Cegan, Radim, Vrana, Jan, Deschamps, Clothilde, Tavares, Raquel, Hobza, Roman, Picard, Franck, Widmer, Alex, Marais, Gabriel A. B.

Journal:

Année:

2018

Langue:

english

Fichier:

PDF, 1.48 MB

english, 2018

15

Performance of empirical potentials (AMBER, CFF95, CVFF, CHARMM, OPLS, POLTEV), semiempirical quantum chemical methods (AM1, MNDO/M, PM3), andab initio Hartree-Fock method for interaction of DNA bases: Comparison with nonempirical beyond Hartree-Fock results

Hobza, Pavel, Kabel�?, Martin, ?poner, Ji?�, Mejzl�k, Petr, Vondr�?ek, Ji?�

Journal:

Journal of Computational Chemistry

Année:

1997

Langue:

english

Fichier:

PDF, 373 KB

english, 1997

16

DNA base amino groups and their role in molecular interactions: Ab initio and preliminary density functional theory calculations

Jiří Šponer, Pavel Hobza

Journal:

International Journal of Quantum Chemistry

Année:

1996

Langue:

english

Fichier:

PDF, 874 KB

english, 1996

17

Electronic properties, hydrogen bonding, stacking, and cation binding of DNA and RNA bases

Jiří Šponer, Jerzy Leszczynski, Pavel Hobza

Journal:

Année:

2001

Langue:

english

Fichier:

PDF, 628 KB

english, 2001

18

Dispersion Interactions Govern the Strong Thermal Stability of a Protein

Jiří Vondrášek, Tomáš Kubař, Francis E. Jenney Jr., Michael W. W. Adams, Milan Kožíšek, Jiří Černý, Vladimír Sklenář, Pavel Hobza

Journal:

Chemistry - A European Journal

Année:

2007

Langue:

english

Fichier:

PDF, 404 KB

english, 2007

19

Thermodynamic characteristics for the formation of H-bonded DNA base pairs

Pavel Hobza, Jiří Šponer

Journal:

Chemical Physics Letters

Année:

1996

Langue:

english

Fichier:

PDF, 481 KB

english, 1996

20

Rényi statistics for testing equality of autocorrelation coefficients

Tomáš Hobza, Domingo Morales, Leandro Pardo

Journal:

Statistical Methodology

Année:

2009

Langue:

english

Fichier:

PDF, 760 KB

english, 2009

21

On convergence of fisher informations in continuous models with quantized observations

Tomáš Hobza, Isabel Molina, Igor Vajda

Journal:

Année:

2005

Langue:

english

Fichier:

PDF, 1.03 MB

english, 2005

22

Chromosomal location and gene paucity of the male specific region on papaya Y chromosome

Qingyi Yu, Shaobin Hou, Roman Hobza, F. Alex Feltus, Xiue Wang, Weiwei Jin, Rachel L. Skelton, Andrea Blas, Cornelia Lemke, Jimmy H. Saw, Paul H. Moore, Maqsudul Alam, Jiming Jiang, Andrew H. Paterson

Journal:

Molecular Genetics and Genomics

Année:

2007

Langue:

english

Fichier:

PDF, 448 KB

english, 2007

23

Blue shiftsvsred shifts in σ-hole bonding

Jane S. Murray, Monica C. Concha, Pat Lane, Pavel Hobza, Peter Politzer

Journal:

Journal of Molecular Modeling

Année:

2008

Langue:

english

Fichier:

PDF, 177 KB

english, 2008

24

Semiempirical Quantum Chemical PM6 Method Augmented by Dispersion and H-Bonding Correction Terms Reliably Describes Various Types of Noncovalent Complexes

Řezáč, Jan, Fanfrlík, Jindřich, Salahub, Dennis, Hobza, Pavel

Journal:

Journal of Chemical Theory and Computation

Année:

2009

Langue:

english

Fichier:

PDF, 229 KB

english, 2009

25

Interpretation of Protein/Ligand Crystal Structure using QM/MM Calculations: Case of HIV-1 Protease/Metallacarborane Complex

Fanfrlík, Jindřich, Brynda, Jiří, Řezáč, Jan, Hobza, Pavel, Lepšík, Martin

Journal:

Journal of Physical Chemistry B

Année:

2008

Langue:

english

Fichier:

PDF, 1.34 MB

english, 2008

26

On the Importance and Origin of Aromatic Interactions in Chemistry and Biodisciplines

Riley, Kevin E., Hobza, Pavel

Journal:

Accounts of Chemical Research

Année:

2012

Langue:

english

Fichier:

PDF, 3.72 MB

english, 2012

27

Gender in plants: sex chromosomes are emerging from the fog

Boris Vyskot, Roman Hobza

Journal:

Trends in Genetics

Année:

2004

Langue:

english

Fichier:

PDF, 540 KB

english, 2004

28

Potential Energy Surface for the Benzene Dimer. Results of ab Initio CCSD(T) Calculations Show Two Nearly Isoenergetic Structures: T-Shaped and Parallel-Displaced

Hobza, Pavel, Selzle, Heinrich L., Schlag, Edward W.

Journal:

Journal of Physical Chemistry

Année:

1996

Langue:

english

Fichier:

PDF, 284 KB

english, 1996

29

Stabilization and Structure Calculations for Noncovalent Interactions in Extended Molecular Systems Based on Wave Function and Density Functional Theories

Riley, Kevin E., Pitoňák, Michal, Jurečka, Petr, Hobza, Pavel

Journal:

Chemical Reviews

Année:

2010

Langue:

english

Fichier:

PDF, 1.44 MB

english, 2010

30

Structure, Energetics, and Dynamics of the Nucleic Acid Base Pairs: Nonempirical Ab Initio Calculations

Hobza, Pavel, Šponer, Jiří

Journal:

Chemical Reviews

Année:

1999

Langue:

english

Fichier:

PDF, 344 KB

english, 1999

31

Intermolecular interactions between medium-sized systems. Nonempirical and empirical calculations of interaction energies. Successes and failures

Hobza, Pavel, Zahradnik, Rudolf

Journal:

Chemical Reviews

Année:

1988

Langue:

english

Fichier:

PDF, 4.31 MB

english, 1988

32

Advanced Corrections of Hydrogen Bonding and Dispersion for Semiempirical Quantum Mechanical Methods

Řezáč, Jan, Hobza, Pavel

Journal:

Journal of Chemical Theory and Computation

Année:

2012

Langue:

english

Fichier:

PDF, 985 KB

english, 2012

33

Understanding of Assembly Phenomena by Aromatic−Aromatic Interactions: Benzene Dimer and the Substituted Systems

Lee, Eun Cheol, Kim, Dongwook, Jurečka, Petr, Tarakeshwar, P., Hobza, Pavel, Kim, Kwang S.

Journal:

Journal of Physical Chemistry A

Année:

2007

Langue:

english

Fichier:

PDF, 672 KB

english, 2007

34

Describing Noncovalent Interactions beyond the Common Approximations: How Accurate Is the “Gold Standard,” CCSD(T) at the Complete Basis Set Limit?

Řezáč, Jan, Hobza, Pavel

Journal:

Journal of Chemical Theory and Computation

Année:

2013

Langue:

english

Fichier:

PDF, 655 KB

english, 2013

35

On the Association of the Base Pairs on the Silica Surface Based on Free Energy Biased Molecular Dynamics Simulation and Quantum Mechanical Calculations

Haldar, Susanta, Spiwok, Vojtech, Hobza, Pavel

Journal:

The Journal of Physical Chemistry C

Année:

2013

Langue:

english

Fichier:

PDF, 3.55 MB

english, 2013

36

The dihydrogen bond in X3C?H?H?M complexes (X = F, Cl, Br; M = Li, Na, K). A correlated quantum chemical ab initio and density functional theory study

Zierkiewicz, Wiktor, Hobza, Pavel

Journal:

Physical Chemistry Chemical Physics

Année:

2004

Langue:

english

Fichier:

PDF, 589 KB

english, 2004

37

Extensions of the S66 Data Set: More Accurate Interaction Energies and Angular-Displaced Nonequilibrium Geometries

Řezáč, Jan, Riley, Kevin E., Hobza, Pavel

Journal:

Journal of Chemical Theory and Computation

Année:

2011

Langue:

english

Fichier:

PDF, 1.03 MB

english, 2011

38

Potential Energy Surface of the Benzene Dimer: Ab Initio Theoretical Study

Hobza, Pavel, Selzle, Heinrich L., Schlag, Edward W.

Journal:

Journal of the American Chemical Society

Année:

1994

Langue:

english

Fichier:

PDF, 900 KB

english, 1994

39

Quantum Monte Carlo Methods Describe Noncovalent Interactions with Subchemical Accuracy

Dubecký, Matúš, Jurečka, Petr, Derian, René, Hobza, Pavel, Otyepka, Michal, Mitas, Lubos

Journal:

Journal of Chemical Theory and Computation

Année:

2013

Langue:

english

Fichier:

PDF, 684 KB

english, 2013

40

CCSD[T] Describes Noncovalent Interactions Better than the CCSD(T), CCSD(TQ), and CCSDT Methods

Řezáč, Jan, Šimová, Lucia, Hobza, Pavel

Journal:

Journal of Chemical Theory and Computation

Année:

2013

Langue:

english

Fichier:

PDF, 848 KB

english, 2013

41

Quantum Monte Carlo for noncovalent interactions: an efficient protocol attaining benchmark accuracy

Dubecký, Matúš, Derian, René, Jurečka, Petr, Mitas, Lubos, Hobza, Pavel, Otyepka, Michal

Journal:

Physical Chemistry Chemical Physics

Année:

2014

Langue:

english

Fichier:

PDF, 1.56 MB

english, 2014

42

Dimers of rare gas atoms: CCSD(T), CCSDT and FCI calculations on the (He)2 dimer, CCSD(T) and CCSDT calculations on the (Ne)2 dimer, and CCSD(T) all-electron and pseudopotential calculations on the dimers from (Ne)2 through (Xe)2

BURDA, J. V., ZAHRADNÍK, R., HOBZA, P.

Journal:

Molecular Physics

Année:

1996

Langue:

english

Fichier:

PDF, 400 KB

english, 1996

43

Computer Modeling of Halogen Bonds and Other σ-Hole Interactions

Kolář, Michal H., Hobza, Pavel

Journal:

Chemical Reviews

Année:

2016

Langue:

english

Fichier:

PDF, 4.41 MB

english, 2016

44

Gender role conflict, drive for muscularity, and the impact of ideal media portrayals on men.

Hobza, Cody L., Rochlen, Aaron B.

Journal:

Psychology of Men and Masculinity

Année:

2009

Langue:

english

Fichier:

PDF, 61 KB

english, 2009

45

Unraveling the Structure–Affinity Relationship between Cucurbit[ n ]urils ( n = 7, 8) and Cationic Diamondoids

Sigwalt, David, Šekutor, Marina, Cao, Liping, Zavalij, Peter Y., Hostaš, Jiří, Ajani, Haresh, Hobza, Pavel, Mlinarić-Majerski, Kata, Glaser, Robert, Isaacs, Lyle

Journal:

Journal of the American Chemical Society

Année:

2017

Langue:

english

Fichier:

PDF, 1.02 MB

english, 2017

46

Understanding the spin-dependent electronic properties of symmetrically far-edge doped zigzag graphene nanoribbon from a first principles study

Sarmah, Amrit, Hobza, Pavel

Journal:

Année:

2017

Langue:

english

Fichier:

PDF, 1.64 MB

english, 2017

47

Ranking Power of the SQM/COSMO Scoring Function on Carbonic Anhydrase II-Inhibitor Complexes

Pecina, Adam, Brynda, Jiri, Vrzal, Lukas, Gnanasekaran, Ramachandran, Horejsi, Magdalena, Eyrilmez, Saltuk, Rezac, Jan, Lepsik, Martin, Rezacova, Pavlina, Hobza, Pavel, Majer, Pavel, Veverka, Vaclav,

Journal:

Année:

2018

Langue:

english

Fichier:

PDF, 1.58 MB

english, 2018

48

Various types of non-covalent interactions contributing towards crystal packing of halogenated diphospha-dicarbaborane with an open pentagonal belt

Holub, Josef, Růžičková, Zdeňka, Hobza, Pavel, Fanfrlík, Jindřich, Hnyk, Drahomír, Růžička, Aleš

Journal:

New Journal of Chemistry

Année:

2018

Langue:

english

Fichier:

PDF, 1.86 MB

english, 2018

49

Irrigated agriculture and future climate change effects on groundwater recharge, northern High Plains aquifer, USA

Lauffenburger, Zachary H., Gurdak, Jason J., Hobza, Chris, Woodward, Duane, Wolf, Cassandra

Journal:

Agricultural Water Management

Année:

2018

Langue:

english

Fichier:

PDF, 1.54 MB

english, 2018

50

Efficiency of Energy Harvesting in Ni–Mn–Ga Shape Memory Alloys

Lindquist, Paul, Hobza, Tony, Patrick, Charles, Müllner, Peter

Journal:

Shape Memory and Superelasticity

Année:

2018

Langue:

english

Fichier:

PDF, 1.31 MB

english, 2018