| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Andreas Karachalios, Erich Hückel (1896–1980): From Physics to Quantum Chemistry
|
Hargittai, Istvan
|
|
2010
|
21 |
6 |
p. 1315-1318
|
artikel
|
| 2 |
A theoretical study of the structure and aromaticity of nitrogen-containing thiocarbon
|
Gu, Wen-Xiu
|
|
2010
|
21 |
6 |
p. 1221-1226
|
artikel
|
| 3 |
Density functional theory investigation on the electronic structure of furo[3,4-b]pyridine-type heterocyclics: from monomer to polymer
|
Ou, Pansheng
|
|
2010
|
21 |
6 |
p. 1253-1261
|
artikel
|
| 4 |
DFT studies on tautomeric preferences of 1-(pyridin-2-yl)-4-(quinolin-2-yl)butane-2,3-dione in the gas phase and in solution
|
Dobosz, Robert
|
|
2010
|
21 |
6 |
p. 1283-1287
|
artikel
|
| 5 |
From Democritus to Schrödinger: a reflection on quantum molecular modeling
|
Vasilescu, Dan
|
|
2010
|
21 |
6 |
p. 1289-1314
|
artikel
|
| 6 |
Graphene 2010
|
Hargittai, István
|
|
2010
|
21 |
6 |
p. 1151-1154
|
artikel
|
| 7 |
Investigation of correlation between impact sensitivities and bond dissociation energies in some triazole energetic compounds
|
Jun, Zhao
|
|
2010
|
21 |
6 |
p. 1235-1240
|
artikel
|
| 8 |
Mesomeric effect on the structural and electronic properties of 4-(2-tert-butyl-4-methylphenoxy)phthalonitrile
|
Karabıyık, Hasan
|
|
2010
|
21 |
6 |
p. 1273-1281
|
artikel
|
| 9 |
Molecularly imprinted polymers for detection of explosives: computational study on molecular interactions of 2,6-dinitrotoluene and methacrylic acid complex
|
Saloni, Julia
|
|
2010
|
21 |
6 |
p. 1171-1184
|
artikel
|
| 10 |
N-Alkoxy-3,5-dinitro-4-aminobenzoic acid derivatives with controlled physico-chemical properties
|
Tudose, Madalina
|
|
2010
|
21 |
6 |
p. 1227-1234
|
artikel
|
| 11 |
NMR elucidation of novel SQ109 derivatives
|
Onajole, Oluseye K.
|
|
2010
|
21 |
6 |
p. 1203-1209
|
artikel
|
| 12 |
Paradigms and paradoxes: the conformation of the fundamental unit of hyaluronic acid
|
Varga, Zoltán
|
|
2010
|
21 |
6 |
p. 1211-1214
|
artikel
|
| 13 |
Quantitative structure–property relationship studies of gas-to-wet butyl acetate partition coefficient of some organic compounds using genetic algorithm and artificial neural network
|
Golmohammadi, Hassan
|
|
2010
|
21 |
6 |
p. 1241-1252
|
artikel
|
| 14 |
Remarkable diversity of carbon–carbon bonds: structures and properties of fullerenes, carbon nanotubes, and graphene
|
Dinadayalane, T. C.
|
|
2010
|
21 |
6 |
p. 1155-1169
|
artikel
|
| 15 |
The influence of solvent and ligands on characters of ZnS clusters
|
Wang, Chunlei
|
|
2010
|
21 |
6 |
p. 1215-1219
|
artikel
|
| 16 |
Theoretical study of hyaluronan oligosaccharides
|
Pogány, Péter
|
|
2010
|
21 |
6 |
p. 1185-1194
|
artikel
|
| 17 |
Theoretical study on a new kind of thienyl-functionalized polysilane
|
Ding, Yunqiao
|
|
2010
|
21 |
6 |
p. 1263-1271
|
artikel
|
| 18 |
Three isostructural 3D supramolecules with p-thioacetatebenzoic acid ligand: syntheses, structure characterizations, and properties
|
Zhan, Cai-Hong
|
|
2010
|
21 |
6 |
p. 1195-1201
|
artikel
|
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