화학공학소재연구정보센터
검색결과 : 20건
No. Article
1 Oxalic Acid Adsorption on Rutile: Molecular Dynamics and ab Initio Calculations
Biriukov D, Kroutil O, Kabelac M, Ridley MK, Machesky ML, Predota M
Langmuir, 35(24), 7617, 2019
2 Structural Stability of Peptidic His-Containing Proton Wire in Solution and in the Adsorbed State
Dorcak V, Novak D, Kabelac M, Kroutil O, Bednarova L, Veverka V, Vacek J
Langmuir, 34(24), 6997, 2018
3 Resonant Infrared Multiple Photon Dissociation Spectroscopy of Anionic Nucleotide Monophosphate Clusters
Ligare MR, Rijs AM, Berden G, Kabelac M, Nachtigallova D, Oomens J, de Vries MS
Journal of Physical Chemistry B, 119(25), 7894, 2015
4 Mechanism of the cis-[Pt(1R,2R-DACH)(H2O)(2)](2+) Intrastrand Binding to the Double-Stranded (pGpG)center dot(CpC) Dinucleotide in Aqueous Solution: A Computational DFT Study
Chval Z, Kabelac M, Burda JV
Inorganic Chemistry, 52(10), 5801, 2013
5 Structure of 2,4-Diaminopyrimidine-Theobromine Alternate Base Pairs
Gengeliczki Z, Callahan MP, Kabelac M, Rijs AM, de Vries MS
Journal of Physical Chemistry A, 115(41), 11423, 2011
6 Double-Helical -> Ladder Structural Transition in the B-DNA is Induced by a Loss of Dispersion Energy
Cerny J, Kabelac M, Hobza P
Journal of the American Chemical Society, 130(47), 16055, 2008
7 The Mid-IR spectra of 9-ethyl guanine, guanosine, and 2-Deoxyguanosine
Abo-Riziq A, Crews BO, Compagnon I, Oomens J, Meijer G, Von Helden G, Kabelac M, Hobza P, de Vries MS
Journal of Physical Chemistry A, 111(31), 7529, 2007
8 Stability of nucleic acid base pairs in organic solvents: Molecular dynamics, molecular dynamics/quenching, and correlated ab initio study
Zendlova L, Hobza P, Kabelac M
Journal of Physical Chemistry B, 111(10), 2591, 2007
9 Na+, Mg2+, and Zn2+ binding to all tautomers of adenine, cytosine, and thymine and the eight most stable keto/enol tautomers of guanine: A correlated ab initio quantum chemical study
Kabelac M, Hobza P
Journal of Physical Chemistry B, 110(29), 14515, 2006
10 Ultrafast deactivation processes in aminopyridine clusters: Excitation energy dependence and isotope effects
Samoylova E, Smith VR, Ritze HH, Radloff W, Kabelac M, Schultz T
Journal of the American Chemical Society, 128(49), 15652, 2006