Zobrazeno 1 - 10
of 69
pro vyhledávání: '"Ödön Farkas"'
Publikováno v:
SSRN Electronic Journal.
Autor:
Ödön Farkas, Károly Kubicskó
Publikováno v:
Organicbiomolecular chemistry. 18(47)
The endogenous psychedelic (mind-altering) N,N-dimethyltryptamine (DMT) molecule has an important role in tissue protection, regeneration, and immunity via sigma-1 receptor activation as its natural ligand. The immunologic properties of DMT suggest t
Publikováno v:
J PHYS ORG CHEM JOURNAL OF PHYSICAL ORGANIC CHEMISTRY In press.
Autor:
András Perczel, Béla Viskolcz, Imre Jákli, Ödön Farkas, Szilard N. Fejer, Svend J. Knak Jensen, Imre G. Csizmadia
Publikováno v:
Jákli, I, Csizmadia, I G, Fejer, S N, Farkas, Ö, Viskolcz, B, Jensen, S K & Perczel, A 2013, ' Helix compactness and stability : Electron structure calculations of conformer dependent thermodynamic functions ', Chemical Physics Letters, vol. 563, pp. 80-87 . https://doi.org/10.1016/j.cplett.2013.01.060
Structure, stability, cooperativity and molecular packing of two major backbone forms: 310-helix and β-strand are investigated. Long models HCO-(Xxx)n-NH2 Xxx = Gly and (l-)Ala, n ⩽ 34, are studied at two levels of theory including the effect of d
Publikováno v:
Journal of Physical Organic Chemistry. 25:1086-1096
Density functional theory computations have been performed on the oxidations of sulfides and sulfoxides with hypochlorite ion (OCl−), hypochlorous acid, and alkyl hypochlorites to study the mechanism of the reactions. The OCl− anion transforms su
Publikováno v:
Chemistry - A European Journal. 18:7793-7802
Quantum mechanics/molecular mechanics calculations in tyrosine ammonia lyase (TAL) ruled out the hypothetical Friedel-Crafts (FC) route for ammonia elimination from L-tyrosine due to the high energy of FC intermediates. The calculated pathway from th
Autor:
Ferenc Ruff, Ödön Farkas
Publikováno v:
Journal of Physical Organic Chemistry. 24:480-491
DFT computations have been performed in acetone and water solvents in order to investigate the mechanism of hydrolysis of acid chlorides. Acetyl chloride and chloroacetyl chloride hydrolyze via concerted, one-step SN2 mechanism, with the attack of wa
Publikováno v:
European Journal of Organic Chemistry. 2009:2102-2111
DFT computations have been performed at different levels of theory to identify the mechanism for the oxidation of sulfides and sulfoxides with periodates. The periodate ion (IO4–), periodic acid (HIO4) and their hydrated derivatives all oxidize sul
Publikováno v:
Journal of Physical Organic Chemistry. 21:988-996
DFT computations have been performed on nucleophilic substitutions of phenacyl bromides with pyridines to investigate the mechanism of the reaction. In contrast with earlier suppositions, tetrahedral intermediate is not formed by the addition of pyri
Publikováno v:
Journal of Mathematical Chemistry. 45:598-606
The linear relationship is still the most important tool for establishing connection between correlating features, properties. The name “parameter-free linear relationship” (PFLR) stands for a new formalism, a generalized interpolation scheme, wh