Sándor Suhai focuses on Protonation, Stereochemistry, Computational chemistry, Dissociation and Density functional theory. Protonation is closely attributed to Fragmentation in his research. Sándor Suhai has included themes like Amino acid and Proton affinity in his Stereochemistry study.
His Computational chemistry research incorporates elements of Glycine, Molecular physics, Ab initio, Hydrogen bond and Conformational isomerism. His Dissociation research integrates issues from Oxazolone, Collision-induced dissociation and Infrared spectroscopy. His research in Density functional theory intersects with topics in Charge density, Potential of mean force, Interaction energy, Quantum and London dispersion force.
His primary scientific interests are in Computational chemistry, Protonation, Molecule, Ab initio and Density functional theory. The Computational chemistry study combines topics in areas such as Vibrational circular dichroism, Intermolecular force, Physical chemistry, Hydrogen bond and Conformational isomerism. His Protonation research is multidisciplinary, incorporating elements of Fragmentation, Stereochemistry, Dissociation and Amide.
His biological study spans a wide range of topics, including Møller–Plesset perturbation theory, Molecular physics, Chemical physics and Ab initio quantum chemistry methods. His Density functional theory research is classified as research in Quantum mechanics. His specific area of interest is Quantum mechanics, where Sándor Suhai studies Tight binding.
Sándor Suhai focuses on Density functional theory, Stereochemistry, Molecule, Protonation and Potential energy. As a member of one scientific family, Sándor Suhai mostly works in the field of Density functional theory, focusing on Amino acid and, on occasion, Solvation. As part of one scientific family, he deals mainly with the area of Stereochemistry, narrowing it down to issues related to the Proton affinity, and often Mole, Affinities, Mass spectrometry and Collision-induced dissociation.
His studies deal with areas such as Oxazolone, Fragmentation, Dissociation and Peptide as well as Protonation. His Dissociation research incorporates themes from Ion, Spectroscopy, Crystallography and Infrared spectroscopy. His research on Potential energy concerns the broader Quantum mechanics.
His main research concerns Stereochemistry, Protonation, Ion, Fragmentation and Density functional theory. His research on Stereochemistry frequently connects to adjacent areas such as Peptide. His Protonation study combines topics in areas such as Oxazolone and Dissociation.
His Ion study combines topics from a wide range of disciplines, such as Cytosine, Computational chemistry and Base pair. His Fragmentation research also works with subjects such as
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Self-consistent-charge density-functional tight-binding method for simulations of complex materials properties
M. Elstner;M. Elstner;D. Porezag;G. Jungnickel;J. Elsner.
Physical Review B (1998)
Fragmentation pathways of protonated peptides
Béla Paizs;Sándor Suhai.
Mass Spectrometry Reviews (2005)
Hydrogen bonding and stacking interactions of nucleic acid base pairs: A density-functional-theory based treatment
Marcus Elstner;Pavel Hobza;Thomas Frauenheim;Sándor Suhai.
Journal of Chemical Physics (2001)
Human papillomavirus type 16 DNA sequence
Klaus Seedorf;Günter Krämmer;Matthias Dürst;Sandor Suhai.
Virology (1985)
A Self‐Consistent Charge Density‐Functional Based Tight‐Binding Method for Predictive Materials Simulations in Physics, Chemistry and Biology
Th. Frauenheim;G. Seifert;M. Elsterner;Z. Hajnal.
Physica Status Solidi B-basic Solid State Physics (2000)
Atomistic simulations of complex materials: ground-state and excited-state properties
Thomas Frauenheim;Gotthard Seifert;Marcus Elstner;Thomas Niehaus.
Journal of Physics: Condensed Matter (2002)
Epigenetic Reactivation of Tumor Suppressor Genes by a Novel Small-Molecule Inhibitor of Human DNA Methyltransferases
Bodo Brueckner;Regine Garcia Boy;Pawel Siedlecki;Pawel Siedlecki;Tanja Musch.
Cancer Research (2005)
Theoretical Study of Aqueous N-Acetyl-l-alanine N‘-Methylamide: Structures and Raman, VCD, and ROA Spectra
Wen-Ge Han;K. J. Jalkanen;and Marcus Elstner;Sándor Suhai.
Journal of Physical Chemistry B (1998)
Tight-binding approach to time-dependent density-functional response theory
Thomas A. Niehaus;S. Suhai;F. Della Sala;P. Lugli.
Physical Review B (2001)
A Self-Consistent Charge Density-Functional Based Tight-Binding Scheme for Large Biomolecules
M. Elstner;Th. Frauenheim;E. Kaxiras;G. Seifert.
Physica Status Solidi B-basic Solid State Physics (2000)
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