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Showing results 109 to 128 of 17604 < previous   next >
TitleAuthor(s)Issue date
Ab initio and density functional theory studies for the explanation of the antioxidant activity of certain phenolic acidsBakalbassis, E. G.; Chatzopoulou, A.; Melissas, V. S.; Tsimidou, M.; Tsolaki, M.; Vafiadis, A.24-Nov-2015
Ab initio and DFT investigation of the structural and thermochemical properties of the peroxy radicals CH3S(O)nOO and the peroxynitrate compounds CH3S(O)nOONO2 (n=0, 1, 2)Zoi Salta,; Agnie M. Kosmas; Antonija Lesar24-Nov-2015
Ab initio and RRKM calculations for the decomposition channels of CH3OBr and BrCH2OHD.K. Papayannis,; E. Drougas,; Agnie M. Kosmas24-Nov-2015
Ab initio and RRKM calculations for the decomposition channels of CH3OBr and BrCH2OHPapayannis, D. K.; Drougas, E.; Kosmas, A. M.24-Nov-2015
Ab Initio and RRKM studies of decomposition and interconvesrion pathways of ClCH2OH and CH3OCl isomeric speciesDrougas, E.,; Kosmas, Agnie M.,; Schnell, M.,; Muhlhauser, M.,; Peyerimhoff, S. D.24-Nov-2015
Ab initio calculations for (BrO)(2) system and quasiclassical dynamics study of BrO self-reactionPapayannis, D.; Kosmas, A. M.; Melissas, V. S.24-Nov-2015
Ab Initio Characterization of (CH3IO3) Isomers and the CH3O2 + IO Reaction PathwaysKosmas, E. Drougas; Agnie M. Kosmas24-Nov-2015
Ab initio characterization of (INO3) isomersD.K. Papayannis,; Agnie M. Kosmas24-Nov-2015
The ab initio characterization of the reaction I+NO2D.K. Papayannis,; Agnie M. Kosmas24-Nov-2015
An ab initio dynamics study of the CH3Cl+OHreactionTzima, T. D.; Papayannis, D. K.; Melissas, V. S.24-Nov-2015
Ab initio investigation of isomeric and conformeric structures of halogen nitrites, XONO (X = Cl, Br, I)Papayannis, D. K.; Kosmas, A. M.24-Nov-2015
Ab initio investigation of isomeric and conformeric structures of halogen nitrites, XONO (X"‰="‰Cl, Br, I)D.K. Papayannis,; Agnie M. Kosmas24-Nov-2015
Ab initio molecular orbital and RRKM calculations of the thermal decomposition of CH2BrO radicalE. Drougas,; Agnie M. Kosmas24-Nov-2015
Ab initio molecular orbital calculations of solvent clusters of trans-N-methylacetamide: Structure, ring cluster formation and out-of-plane deformationDemetropoulos, I. N.; Gerothanassis, I. P.; Vakka, C.; Kakavas, C.24-Nov-2015
Ab initio Quantum Chemical Study of the Coordination Preferences and Catalytic Role of Cu+ Ions in the Dehydration Reactions of Hydroxyformaldoxime Conformers and the oxidation of HCN to Hydroxyformaldoxime by Hydrogen PeroxidePantazis, D. A.; Tsipis, A. C.; Tsipis, C. A.24-Nov-2015
Ab initio study of the structure of aniline in the S-1 and S-2 pi pi statesDrougas, E.; Philis, J. G.; Kosmas, A. M.24-Nov-2015
Ab initio study of the structure of aniline in the S1 and S2 ππ* statesE. Drougas,; J. Philis,; Agnie M. Kosmas24-Nov-2015
Abatacept: a biologic immune modulator for rheumatoid arthritisPapagoras, C.; Drosos, A. A.24-Nov-2015
Abdominal aortic aneurysms and ureteric obstructionVandendris, M.; Giannakopoulos, X.; Schulman, C. C.24-Nov-2015
Abdominal aortic endograft proximal collapse: Successful repair by endovascular meansMatsagas, M. I.; Papakostas, J. C.; Arnaoutoglou, H. M.; Michalis, L. K.24-Nov-2015