| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A force field for dynamic Cu-BTC metal-organic framework
|
Zhao, Lei
|
|
2010
|
17 |
2 |
p. 227-234
|
artikel
|
| 2 |
Analysis of structural water and CH···π interactions in HIV-1 protease and PTP1B complexes using a hydrogen bond prediction tool, HBPredicT
|
Yesudas, Joshy P.
|
|
2010
|
17 |
2 |
p. 401-413
|
artikel
|
| 3 |
A physical model for PDZ-domain/peptide interactions
|
Kaufmann, Kristian
|
|
2010
|
17 |
2 |
p. 315-324
|
artikel
|
| 4 |
Aqueous solubility of a diatomic molecule as a function of its size & electronegativity difference
|
Al-Malah, Kamal I.
|
|
2010
|
17 |
2 |
p. 325-331
|
artikel
|
| 5 |
Density functional theory study on (LiNH2)n (n = 1–5) clusters
|
Zhou, Su-Qin
|
|
2010
|
17 |
2 |
p. 235-242
|
artikel
|
| 6 |
Docking study and binding free energy calculation of poly (ADP-ribose) polymerase inhibitors
|
Ohno, Kazuki
|
|
2010
|
17 |
2 |
p. 383-389
|
artikel
|
| 7 |
3D QSAR pharmacophore model based on diverse IKKβ inhibitors
|
Nagarajan, Shanthi
|
|
2010
|
17 |
2 |
p. 209-218
|
artikel
|
| 8 |
Electronic properties of neuroleptics: ionization energies of benzodiazepines
|
Millefiori, Salvatore
|
|
2010
|
17 |
2 |
p. 281-287
|
artikel
|
| 9 |
Homology modeling, molecular dynamic simulation and docking studies of cyclin dependent kinase 1
|
Zhang, Lei
|
|
2010
|
17 |
2 |
p. 219-226
|
artikel
|
| 10 |
Identification of folding preferences of cleavage junctions of HIV-1 precursor proteins for regulation of cleavability
|
Ode, Hirotaka
|
|
2010
|
17 |
2 |
p. 391-399
|
artikel
|
| 11 |
Insight into residues involved in the structure and function of the breast cancer associated protein human gamma synuclein
|
Manivel, Panneerselvam
|
|
2010
|
17 |
2 |
p. 251-263
|
artikel
|
| 12 |
Interaction between alkaline earth cations and oxo-ligands. DFT study of the affinity of the Ca2+ cation for carbonyl ligands
|
Costa, Leonardo Moreira da
|
|
2010
|
17 |
2 |
p. 243-249
|
artikel
|
| 13 |
Molecular modeling studies of Fatty acyl-CoA synthetase (FadD13) from Mycobacterium tuberculosis—a potential target for the development of antitubercular drugs
|
Jatana, Nidhi
|
|
2010
|
17 |
2 |
p. 301-313
|
artikel
|
| 14 |
QSAR, DFT and quantum chemical studies on the inhibition potentials of some carbozones for the corrosion of mild steel in HCl
|
Eddy, Nnabuk O.
|
|
2010
|
17 |
2 |
p. 359-376
|
artikel
|
| 15 |
The binding modes and binding affinities of artemisinin derivatives with Plasmodium falciparum Ca2+-ATPase (PfATP6)
|
Naik, Pradeep Kumar
|
|
2010
|
17 |
2 |
p. 333-357
|
artikel
|
| 16 |
The effect of calciums on molecular motions of proteinase K
|
Liu, Shu-Qun
|
|
2010
|
17 |
2 |
p. 289-300
|
artikel
|
| 17 |
The effect of Li+ on GSK-3 inhibition: Molecular dynamics simulation
|
Sun, Hao
|
|
2010
|
17 |
2 |
p. 377-381
|
artikel
|
| 18 |
The studies on the aromaticity of fullerenes and their holmium endohedral compounds
|
Tan, Bisheng
|
|
2010
|
17 |
2 |
p. 275-279
|
artikel
|
| 19 |
Virtual screening of specific chemical compounds by exploring E.coli NAD+-dependent DNA ligase as a target for antibacterial drug discovery
|
Akhoon, Bashir Akhlaq
|
|
2010
|
17 |
2 |
p. 265-273
|
artikel
|
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