| no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
| 1 |
Ab Initio studies of receptor interactions with AMPA ((S)-2-amino-3-(3-hydroxy-5-methyl-4-isoxazolyl) propionic acid ) and Kainic acid (2S-(2α,3β,4β))-2-carboxy-4-(1-methylethenyl)-3-pyrrolidineacetic acid
|
Champeil, Elise
|
|
2009
|
15 |
9 |
p. 1109-1117
|
article
|
| 2 |
Adsorption of CO on Cu (110) and (100) surfaces using COSMO-based DFT
|
Zuo, Zhijun
|
|
2009
|
15 |
9 |
p. 1079-1083
|
article
|
| 3 |
Analysis of oligomeric proteins during unfolding by pH and temperature
|
Bhattacharya, Pradip
|
|
2009
|
15 |
9 |
p. 1013-1025
|
article
|
| 4 |
Chemical function-based pharmacophore generation of selective κ-opioid receptor agonists by catalyst and phase
|
Zhang, Jing
|
|
2008
|
15 |
9 |
p. 1027-1041
|
article
|
| 5 |
Homology modeling of a novel epoxide hydrolase (EH) from Aspergillus niger SQ-6: structure-activity relationship in expoxides inhibiting EH activity
|
Luo, Quan
|
|
2009
|
15 |
9 |
p. 1125-1132
|
article
|
| 6 |
Homology modeling of human α1β2γ2 and house fly β3 GABA receptor channels and Surflex-docking of fipronil
|
Cheng, Jin
|
|
2009
|
15 |
9 |
p. 1145-1153
|
article
|
| 7 |
Optical and vibrational properties of 1,2-benzenedicarboxylic anhydride
|
Safinejad, F.
|
|
2009
|
15 |
9 |
p. 1119-1124
|
article
|
| 8 |
Performance of Becke’s half-and-half functional for non-covalent interactions: energetics, geometries and electron densities
|
Gkionis, Konstantinos
|
|
2009
|
15 |
9 |
p. 1051-1060
|
article
|
| 9 |
Quantum chemical study of the inhibition of the corrosion of mild steel in H2SO4 by some antibiotics
|
Eddy, Nnabuk O.
|
|
2009
|
15 |
9 |
p. 1085-1092
|
article
|
| 10 |
Solvent accessible surface area approximations for rapid and accurate protein structure prediction
|
Durham, Elizabeth
|
|
2009
|
15 |
9 |
p. 1093-1108
|
article
|
| 11 |
Theoretical evaluation of the order of reactivity of transfer agents utilized in RAFT polymerization: group Z
|
Rodríguez-Sanchez, Isis
|
|
2009
|
15 |
9 |
p. 1133-1143
|
article
|
| 12 |
Theoretical kinetic study of the formation reactions of methanol and methyl hypohalites in the gas phase
|
Brudnik, Katarzyna
|
|
2009
|
15 |
9 |
p. 1061-1066
|
article
|
| 13 |
Theoretical study of the geometrical and electronic structures and thermochemistry of spherophanes
|
Saal, Amar
|
|
2009
|
15 |
9 |
p. 1067-1078
|
article
|
| 14 |
Theoretical study on the thermal decomposition of model compounds for Poly (dialkyl fumarate)
|
Wang, Yanling
|
|
2009
|
15 |
9 |
p. 1043-1049
|
article
|
Journal description