Search results
- 1.0396329 - ÚOCHB 2014 RIV GB eng J - Journal Article
Kysilka, Jiří - Vondrášek, Jiří
A systematic method for analysing the protein hydration structure of T4 lysozyme.
Journal of Molecular Recognition. Roč. 26, č. 10 (2013), s. 479-487. ISSN 0952-3499. E-ISSN 1099-1352
R&D Projects: GA ČR GAP208/10/0725; GA MŠMT(CZ) LH11020
Grant - others:GA ČR(CZ) GAP302/10/0427
Institutional support: RVO:61388963
Keywords : protein hydration structure * water * X-ray crystallography * cluster algorithm * interaction enthalpy
Subject RIV: CE - Biochemistry
Impact factor: 2.337, year: 2013
Permanent Link: http://hdl.handle.net/11104/0224147 - 2.0385763 - ÚOCHB 2013 RIV GB eng J - Journal Article
Kysilka, Jiří - Vondrášek, Jiří
Towards a better understanding of the specificity of protein-protein interaction.
Journal of Molecular Recognition. Roč. 25, č. 11 (2012), s. 604-615. ISSN 0952-3499. E-ISSN 1099-1352
R&D Projects: GA ČR GAP208/10/0725; GA ČR GAP302/10/0427; GA MŠMT(CZ) LH11020
Institutional research plan: CEZ:AV0Z40550506; CEZ:AV0Z50520701
Keywords : protein-protein interaction * molecular recognition * x-ray structure analysis * empirical potentials * side chain-side chain interaction * interaction energy * bioinformatics
Subject RIV: CE - Biochemistry
Impact factor: 3.006, year: 2012
Permanent Link: http://hdl.handle.net/11104/0156114 - 3.0368061 - ÚOCHB 2012 RIV US eng J - Journal Article
Kysilka, Jiří - Rubeš, Miroslav - Grajciar, L. - Nachtigall, P. - Bludský, Ota
Accurate Description of Argon and Water Adsorption on Surfaces of Graphene-Based Carbon Allotropes.
Journal of Physical Chemistry A. Roč. 115, č. 41 (2011), s. 11387-11393. ISSN 1089-5639. E-ISSN 1520-5215
R&D Projects: GA ČR GAP208/10/0725; GA MŠMT LC512
Institutional research plan: CEZ:AV0Z40550506
Keywords : density-functional-theory * coronene * potential-energy surfaces * basis-set convergence * physical adsorption * complexes
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.946, year: 2011
Permanent Link: http://hdl.handle.net/11104/0006698 - 4.0351835 - ÚOCHB 2011 RIV GB eng J - Journal Article
Rubeš, Miroslav - Kysilka, Jiří - Nachtigall, P. - Bludský, Ota
DFT/CC investigation of physical adsorption on a graphite (0001) surface.
Physical Chemistry Chemical Physics. Roč. 12, č. 24 (2010), s. 6438-6444. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA ČR GAP208/10/0725; GA MŠMT LC512
Institutional research plan: CEZ:AV0Z40550506
Keywords : potential-energy surfaces * long-range * water * benzene * desorption
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 3.454, year: 2010
Permanent Link: http://hdl.handle.net/11104/0191494