Pavel Hobza

Materials Chemistry · 2000–2013

A researcher in the Science corpus: 12 papers; trusts 4 researchers and is trusted by 22 researchers here, as inferred from the citation graph.

Subfields

• Materials Chemistry — 223 citations into it
• Atomic and Molecular Physics, and Optics — 66 citations into it; #623 of 7,135 by trust here, #434 by citations
• Physical and Theoretical Chemistry — 29 citations into it; #46 of 671 by trust here, #24 by citations

Whom Pavel Hobza trusts overall

Their strongest outbound trust, strongest first, inferred from their citations.

1. Yan Zhao
2. Stefan Grimme
3. Donald G. Truhlar
4. Kevin E. Riley

Who trusts Pavel Hobza overall

1. Stefan Grimme
2. Narbe Mardirossian
3. Qianli Ma
4. Konrad Patkowski
5. M. Head‐Gordon
6. Yan Zhao
7. D. Yokoyama
8. Jan Rezác
9. Hans-Joachim Werner
10. Robert A. Distasio Jr.

Papers from Pavel Hobza's perspective

Ordered by how strongly the researchers Pavel Hobza trusts endorse each paper. Same corpus, a different order for every researcher.

1. Design of Density Functionals by Combining the Method of Constraint Satisfaction with Parametrization for Thermochemistry, Thermochemical Kinetics, and Noncovalent Interactions. (Journal of Chemical Theory and Computation)
2. Influence of cultivation temperature on the ligninolytic activity of selected fungal strains
3. “Model”
4. Jacob’s ladder of density functional approximations for the exchange-correlation energy
5. Benchmark database of barrier heights for heavy atom transfer, nucleophilic substitution, association, and unimolecular reactions and its use to test theoretical methods. (Journal of Physical Chemistry A)
6. Left-right correlation energy
7. Atlas of Zeolite Framework Types
8. Semiempirical hybrid density functional with perturbative second-order correlation. (Journal of Chemical Physics)
9. Exploring protein native states and large‐scale conformational changes with a modified generalized born model (Proteins: Structure, Function, and Bioinformatics)
10. Luminescent functional metal-organic frameworks. (Chemical Reviews)

Their papers

• Functionalization of graphene: covalent and non-covalent approaches, derivatives and applications. (2012) — 3,740 citations
• Stabilization and structure calculations for noncovalent interactions in extended molecular systems based on wave function and density functional theories. (2010) — 716 citations
• 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. (2006) — 1,488 citations
• Describing Noncovalent Interactions beyond the Common Approximations: How Accurate Is the "Gold Standard," CCSD(T) at the Complete Basis Set Limit? (2013) — 428 citations
• Strength and Character of Halogen Bonds in Protein–Ligand Complexes (2011) — 89 citations
• Noncovalent interactions in biochemistry (2011) — 254 citations
• S66: A Well-balanced Database of Benchmark Interaction Energies Relevant to Biomolecular Structures (2011) — 926 citations
• Extensions of the S66 Data Set: More Accurate Interaction Energies and Angular-Displaced Nonequilibrium Geometries (2011) — 225 citations
• Density functional theory augmented with an empirical dispersion term. Interaction energies and geometries of 80 noncovalent complexes compared with ab initio quantum mechanics calculations (2007) — 563 citations
• The World of Non-Covalent Interactions: 2006 (2006) — 183 citations
• State-of-the-art correlated ab initio potential energy curves for heavy rare gas dimers: Ar2, Kr2, and Xe2 (2003) — 142 citations
• Blue-Shifting Hydrogen Bonds. (2000) — 1,525 citations