| no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
| 1 |
An appraisal of the hydrogen atom transfer mechanism for the reaction between thiourea derivatives and OH radical: A case-study of dimethylthiourea and diethylthiourea
|
Serobatse, Kemoabetswe R.N.
|
|
2017
|
1101 |
C |
p. 83-95
|
article
|
| 2 |
Computational modelling of interactions between gold complexes and silicates
|
Mohammadnejad, Sima
|
|
2017
|
1101 |
C |
p. 113-121
|
article
|
| 3 |
Conformations of n-alkyl-α/β-d-glucopyranoside surfactants: Impact on molecular properties
|
Gaudin, Théophile
|
|
2017
|
1101 |
C |
p. 20-29
|
article
|
| 4 |
Editorial Board
|
|
|
2017
|
1101 |
C |
p. IFC
|
article
|
| 5 |
Evaluation of density functionals for elementary steps of selective oxidation reactions
|
Dinda, Shrabani
|
|
2017
|
1101 |
C |
p. 36-45
|
article
|
| 6 |
Fragment molecular orbital (FMO) calculations on DNA by a scaled third-order Møller-Plesset perturbation (MP2.5) scheme
|
Yamada, Haruka
|
|
2017
|
1101 |
C |
p. 46-54
|
article
|
| 7 |
Interaction and bioconjugation of CdSe/ZnS core/shell quantum dots with maltose-binding protein
|
Kathiresan, R.
|
|
2017
|
1101 |
C |
p. 96-101
|
article
|
| 8 |
Is the bonding cumulenic or polyacetylenic in nonatetraynylidene?
|
Thimmakondu, Venkatesan S.
|
|
2017
|
1101 |
C |
p. 1-7
|
article
|
| 9 |
Novel nanostructures built from Zn12S12 cage-like clusters
|
Lu, Jun-Zhe
|
|
2017
|
1101 |
C |
p. 74-82
|
article
|
| 10 |
Stacking of dicarbonylacetylacetonatorhodium(I) molecules
|
Conradie, Jeanet
|
|
2017
|
1101 |
C |
p. 30-35
|
article
|
| 11 |
Structure and thermodynamic properties of cluster ions in saturated vapour over barium dibromide
|
Jacob, Fortunatus
|
|
2017
|
1101 |
C |
p. 102-112
|
article
|
| 12 |
The mechanism determination of trimer and tetramer HCN for adenine formation in the gas phase of interstellar space
|
Benallou, Abdelilah
|
|
2017
|
1101 |
C |
p. 68-73
|
article
|
| 13 |
Theoretical evidence of triple (σ-, π-, and δ-) aromaticity in the Os3N3 +/− clusters
|
Jin, Qiao
|
|
2017
|
1101 |
C |
p. 127-131
|
article
|
| 14 |
Theoretical prediction on CO insertion reactions through the anionic complex [ClMg(η2-O2C]− as a catalyst
|
Ma, Jin-Feng
|
|
2017
|
1101 |
C |
p. 55-61
|
article
|
| 15 |
Theoretical study of geometric structures and electronic absorption spectra of Iridium(III) complexes based on 2-phenyl-5-nitropyridyl with different ancillary ligands
|
Brahim, Houari
|
|
2017
|
1101 |
C |
p. 8-19
|
article
|
| 16 |
Theoretical study of hydrogen bonding excited states of fluorenone with formaldehyde
|
Yang, Juan
|
|
2017
|
1101 |
C |
p. 62-67
|
article
|
| 17 |
Two-dimensional confinement of hydrogen molecular ion
|
Campoy-Güereña, Germán
|
|
2017
|
1101 |
C |
p. 122-126
|
article
|
Journal description