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プロフィール詳細

プロジェクトを作成

★★★★★

☆☆☆☆☆

★★★★★

☆☆☆☆☆

Dr. Ladislav B.に依頼

プロフィール概要

With a doctorate and postdoc in Computational Molecular Spectroscopy I'm an expert in Quantum Chemistry and Molecular Modeling. I have deep understanding of related methods such as Biophysics, Nuclear Magnetic Resonance and other spectroscopies and broad knowledge in overlapping fields including Molecular Biology, General Physics, Chemistry, Statistics, Programming and Computer Graphics. I'm also an accomplished pianist.

専門分野

• ☆ Physical Chemistry
• ☆ Molecular Modeling
• ☆ Spectroscopy
• ☆ Quantum Chemistry
• ☆ Biophysics
• ☆ Physics
• ☆ Quantum Mechanics

サービス

• Consulting
• Product Development

職務経験

Postdoctoral researcher

Centre de RMN à Très Hauts Champs

2月 2016 - 現在

Postdoctoral researcher

Technische Universität Berlin

7月 2012 - 9月 2015

Ph.D. student

Institute of Organic Chemistry and Biochemistry, Academy of Sciences of the Czech Republic

6月 2006 - 6月 2012

学歴

Ph.D.

Faculty of Mathematics and Physics, Charles University in Prague

10月 2006 - 9月 2012

M.Sc. (Biophysics)

Faculty of Mathematics and Physics, Charles University in Prague

10月 2001 - 6月 2006

認定資格

• 認定資格の詳細は未入力です。

出版物

JOURNAL ARTICLE

Ladislav Benda, Andrea Bertarello, Kevin J. Sanders, Andrew J. Pell, Michael J. Knight, Vladimir Pelmenschikov, Leonardo Gonnelli, Isabella C. Felli, Martin Kaupp, Lyndon Emsley, et al.(2020). Picometer Resolution Structure of the Coordination Sphere in the Metal-Binding Site in a Metalloprotein by {NMR} . Journal of the American Chemical Society. 142. (39). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 16757--16765. American Chemical Society ({ACS})

(2020). Pico-meter resolution structure of the coordination sphere in the metal-binding site in a metalloprotein by NMR . Journal of the American Chemical Society.

(2020). Paramagnetic Cobalt(II) Complexes with Cyclam Derivatives: Toward 19F MRI Contrast Agents . Inorganic Chemistry.

Ladislav Benda, Giacomo Parigi, Enrico Ravera, Maurizio Romanelli, Claudio Luchinat(2019). Pseudocontact shifts and paramagnetic susceptibility in semiempirical and quantum chemistry theories . The Journal of Chemical Physics. 150. (14). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 144101. {AIP} Publishing

Benda, Ladislav, Srb, Pavel, Svoboda, Michal, Lepsik, Martin, Tarabek, Jan, Sicha, Vaclav, Gruener, Bohumir, Grantz-Saskova, Klara, Brynda, Jiri, Rezacova, Pavlina, et al.(2019). Capturing a dynamically interacting inhibitor by paramagnetic NMR spectroscopy . Physical Chemistry Chemical Physics. 21. (10). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 5661-5673.

Burcher, B., Sanders, K. J., Benda, L., Pintacuda, G., Jeanneau, E., Danopoulos, A. A., Braunstein, P., Olivier-Bourbigou, H., Breuil, P. A. R.(2017). Straightforward Access to Stable, 16-Valence-Electron Phosphine-Stabilized Fe Olefin Complexes and Their Reactivity . Organometallics. 36. (3). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 605-613.

Benda, L., Mares, J., Ravera, E., Parigi, G., Luchinat, C., Kaupp, M., Vaara, J.(2016). Pseudo-Contact NMR Shifts over the Paramagnetic Metalloprotein CoMMP-12 from First Principles . Angewandte Chemie-International Edition. 55. (47). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 14713-14717.

Benda, Ladislav, Andrushchenko, Valery, Pav, Ondrej, Dracinsky, Martin, Bour, Petr(2015). Vibrational Properties of the Phosphate Group Investigated by Molecular Dynamics and Density Functional Theory . Journal of Physical Chemistry B. 119. (33). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 10682-10692.

Benda, Ladislav, Soltesova, Maria, Peksa, Mikulas, Czernek, Jiri, Lang, Jan(2014). Determination of size of molecular clusters of ethanol by means of NMR diffusometry and hydrodynamic calculations . The journal of physical chemistry. B. 118. (24). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 6864-74.

Emmer, J., Vavrinska, A., Sychrovsky, V., Benda, L., Kriz, Z., Koca, J., Boelens, R., Sklenar, V., Trantirek, L.(2013). Influence of the O-phosphorylation of serine, threonine and tyrosine in proteins on the amidic N-15 chemical shielding anisotropy tensors . Journal of Biomolecular Nmr. 55. (1). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 59-70.

(2012). Detection of Mercury–TpT Dinucleotide Binding by Raman Spectra: A Computational Study .

(2012). Correlating the 31P NMR Chemical Shielding Tensor and the 2JP,C Spin–Spin Coupling Constants with Torsion Angles ζ and α in the Backbone of Nucleic Acids .

Uchiyama, T., Miura, T., Takeuchi, H., Dairaku, T., Komuro, T., Kawamura, T., Kondo, Y., Benda, L., Sychrovsky, V., Bour, P., et al.(2012). Raman spectroscopic detection of the T-Hg-II-T base pair and the ionic characteristics of mercury . Nucleic Acids Research. 40. (12). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 5766-5774.

(2011). Calculating the Response of NMR Shielding Tensor σ(31P) and 2J(31P,13C) Coupling Constants in Nucleic Acid Phosphate to Coordination of the Mg2+ Cation .

Benda, L., Straka, M., Tanaka, Y., Sychrovsky, V.(2011). On the role of mercury in the non-covalent stabilisation of consecutive U-Hg(II)-U metal-mediated nucleic acid base pairs: metallophilic attraction enters the world of nucleic acids . Physical Chemistry Chemical Physics. 13. (1). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 100-103.

Dracinsky, M., Benda, L., Bour, P.(2011). Ab initio modeling of fused silica, crystal quartz, and water Raman spectra . Chemical Physics Letters. 512. (1-3). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 54-59.

(2010). Theoretical Modeling of Magnesium Ion Imprints in the Raman Scattering of Water .

(2009). Theoretical Study of the Effective Chemical Shielding Anisotropy (CSA) in Peptide Backbone, Rating the Impact of CSAs on the Cross-Correlated Relaxations inl-Alanyl-l-alanine .

(2008). Probing the Flexibility of Internal Rotation in Silylated Phenols with the NMR Scalar Spin−Spin Coupling Constants .

(2008). Dependence of thel-Alanyl-l-Alanine Conformation on Molecular Charge Determined from Ab Initio Computations and NMR Spectra .