| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
AM1* parameters for cobalt and nickel
|
Kayi, Hakan
|
|
2009
|
16 |
1 |
p. 29-47
|
artikel
|
| 2 |
A theoretical study of red-shifting and blue-shifting hydrogen bonds occurring between imidazolidine derivatives and PEG/PVP polymers
|
Oliveira, Boaz G.
|
|
2009
|
16 |
1 |
p. 119-127
|
artikel
|
| 3 |
Bonding and electronic structures in W@Au12AE complexes (AE= NO+, CO, BF, CN–, or BO–): analogies among ligands isoelectronic to carbon monoxide
|
Fu, Yi
|
|
2009
|
16 |
1 |
p. 9-16
|
artikel
|
| 4 |
Design and synthesis of thiourea based receptor containing naphthalene as oxalate selective sensor
|
Morakot, Nongnit
|
|
2009
|
16 |
1 |
p. 129-136
|
artikel
|
| 5 |
Docking and 3D QSAR studies of protoporphyrinogen oxidase inhibitor 3H-pyrazolo[3,4-d][1,2,3]triazin-4-one derivatives
|
Roy, Kunal
|
|
2009
|
16 |
1 |
p. 137-153
|
artikel
|
| 6 |
Explaining the inhibition of cyclin-dependent kinase 5 by peptides derived from p25 with molecular dynamics simulations and MM-PBSA
|
Tan, Vincent B. C.
|
|
2009
|
16 |
1 |
p. 1-8
|
artikel
|
| 7 |
Generation of a 3D model for human GABA transporter hGAT-1 using molecular modeling and investigation of the binding of GABA
|
Wein, Thomas
|
|
2009
|
16 |
1 |
p. 155-161
|
artikel
|
| 8 |
Hemolytic mechanism of dioscin proposed by molecular dynamics simulations
|
Lin, Fu
|
|
2009
|
16 |
1 |
p. 107-118
|
artikel
|
| 9 |
Insight into ligand selectivity in HCV NS5B polymerase: molecular dynamics simulations, free energy decomposition and docking
|
Li, Tong
|
|
2009
|
16 |
1 |
p. 49-59
|
artikel
|
| 10 |
Insights derived from molecular dynamics simulation into the molecular motions of serine protease proteinase K
|
Liu, Shu-Qun
|
|
2009
|
16 |
1 |
p. 17-28
|
artikel
|
| 11 |
Kinetoplastid RNA editing ligases 1 and 2 exhibit different electrostatic properties
|
Shaneh, Alireza
|
|
2009
|
16 |
1 |
p. 61-76
|
artikel
|
| 12 |
Probing ligand binding modes of Mycobacterium tuberculosis MurC ligase by molecular modeling, dynamics simulation and docking
|
Anuradha, C. M.
|
|
2009
|
16 |
1 |
p. 77-85
|
artikel
|
| 13 |
Theoretical and experimental studies of vibrational spectra and thermal analysis of 2-nitroaniline and its cation
|
Azhagiri, Sachidanandam
|
|
2009
|
16 |
1 |
p. 87-94
|
artikel
|
| 14 |
Theoretical evaluation of the order of reactivity of transfer agents utilized in RAFT polymerization
|
Rodríguez-Sanchez, Isis
|
|
2009
|
16 |
1 |
p. 95-105
|
artikel
|
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