Jaroslav V. Burda

Affiliations: 
Charles University, Prague, Czechia 
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"Jaroslav Burda"
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Šebesta F, Sovová Ž, Burda JV. (2024) Determination of Amino Acids' p: Importance of Cavity Scaling within Implicit Solvation Models and Choice of DFT Functionals. The Journal of Physical Chemistry. B. 128: 1627-1637
Šebesta F, Šebera J, Sychrovský V, et al. (2020) QM and QM/MM umbrella sampling MD study of the formation of Hg(II)-thymine bond: Model for evaluation of the reaction energy profiles in solutions with constant pH. Journal of Computational Chemistry
Kastner A, Poetsch I, Mayr J, et al. (2019) A Dogma in Doubt: Hydrolysis of Equatorial Ligands of Pt Complexes under Physiological Conditions. Angewandte Chemie (International Ed. in English). 58: 7464-7469
Chval Z, Dvořáčková O, Chvalová D, et al. (2019) Square-Planar Pt(II) and Ir(I) Complexes as the Lewis Bases: Donor-Acceptor Adducts with Group 13 Trihalides and Trihydrides. Inorganic Chemistry. 58: 3616-3626
Kastner A, Poetsch I, Mayr J, et al. (2019) Zweifel an einem Dogma: Hydrolyse äquatorialer Liganden von Pt IV ‐Komplexen unter physiologischen Bedingungen Angewandte Chemie. 131: 7542-7547
Špačková N, Trošanová Z, Šebesta F, et al. (2018) Protein environment affects the water-tryptophan binding mode. MD, QM/MM, and NMR studies of engrailed homeodomain mutants. Physical Chemistry Chemical Physics : Pccp. 20: 12664-12677
Vokáčová ZS, Turel I, Burda JV. (2018) Correction to: Exploration of selected electronic characteristics of half-sandwich organoruthenium(II) β-diketonate complexes. Journal of Molecular Modeling. 24: 110
Sochorová Vokáčová Z, Turel I, Burda JV. (2018) Exploration of selected electronic characteristics of half-sandwich organoruthenium(II) β-diketonate complexes. Journal of Molecular Modeling. 24: 98
Maixner M, Dos Santos HF, Burda JV. (2018) Formation of chelate structure between His-Met dipeptide and diaqua-cisplatin complex; DFT/PCM computational study. Journal of Biological Inorganic Chemistry : Jbic : a Publication of the Society of Biological Inorganic Chemistry
Šebesta F, Baxová K, Burda JV. (2018) Redox Potentials for Tetraplatin, Satraplatin, Its Derivatives, and Ascorbic Acid: A Computational Study. Inorganic Chemistry. 57: 951-962
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