| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio and DFT study on the electrophilic addition reaction of bromine to tetracyclo[5.3.0.02,6.03,10]deca–4,8–diene
|
Abbasoglu, Rza
|
|
2006
|
12 |
6 |
p. 991-995
|
artikel
|
| 2 |
A fast surface-matching procedure for protein–ligand docking
|
Yamagishi, Michel E. B.
|
|
2006
|
12 |
6 |
p. 965-972
|
artikel
|
| 3 |
A radial-distribution-function approach for predicting rodent carcinogenicity
|
Helguera, Aliuska Morales
|
|
2006
|
12 |
6 |
p. 769-780
|
artikel
|
| 4 |
A weighted measure for the similarity analysis of DNA sequences
|
Liu, Na
|
|
2006
|
12 |
6 |
p. 897-903
|
artikel
|
| 5 |
Comparative study of eight oxytocin antagonists by simulated annealing
|
Jójárt, Balázs
|
|
2006
|
12 |
6 |
p. 823-828
|
artikel
|
| 6 |
Determining functionally important amino acid residues of the E1 protein of Venezuelan equine encephalitis virus
|
Negi, Surendra S.
|
|
2006
|
12 |
6 |
p. 921-929
|
artikel
|
| 7 |
3D–QSAR studies of orvinol analogs as κ-opioid agonists
|
Li, Wei
|
|
2006
|
12 |
6 |
p. 877-884
|
artikel
|
| 8 |
Fast prediction of protein domain boundaries using conserved local patterns
|
Joshi, Rajani R.
|
|
2006
|
12 |
6 |
p. 943-952
|
artikel
|
| 9 |
FlgM anti-sigma factors: identification of novel members of the family, evolutionary analysis, homology modeling, and analysis of sequence-structure-function relationships
|
Pons, T.
|
|
2006
|
12 |
6 |
p. 973-983
|
artikel
|
| 10 |
FlgM anti-sigma factors: identification of novel members of the family, evolutionary analysis, homology modeling, and analysis of sequence-structure-function relationships
|
Pons, T.
|
|
|
12 |
6 |
p. 973-983
|
artikel
|
| 11 |
Free-energy force-field three-dimensional quantitative structure–activity relationship analysis of a set of p38-mitogen activated protein kinase inhibitors
|
Romeiro, Nelilma Correia
|
|
2006
|
12 |
6 |
p. 855-868
|
artikel
|
| 12 |
Modeling the human PTC bitter-taste receptor interactions with bitter tastants
|
Floriano, Wely B.
|
|
2006
|
12 |
6 |
p. 931-941
|
artikel
|
| 13 |
Modeling the pore structure of voltage-gated sodium channels in closed, open, and fast-inactivated conformation reveals details of site 1 toxin and local anesthetic binding
|
Scheib, Holger
|
|
2006
|
12 |
6 |
p. 813-822
|
artikel
|
| 14 |
Molecular-dynamics simulations of pyronine 6G and rhodamine 6G dimers in aqueous solution
|
Chuichay, Parawan
|
|
2006
|
12 |
6 |
p. 885-896
|
artikel
|
| 15 |
Molecular modeling of the effects of mutant alleles on chalcone synthase protein structure
|
Dana, Christopher D.
|
|
2006
|
12 |
6 |
p. 905-914
|
artikel
|
| 16 |
New complete orthonormal sets of hyperspherical harmonics and their one-range addition and expansion theorems
|
Guseinov, Israfil I.
|
|
2006
|
12 |
6 |
p. 757-761
|
artikel
|
| 17 |
Novel distance-based atom-type topological indices DAI for QSPR/QSAR studies of alcohols
|
Lu, Chunhui
|
|
2006
|
12 |
6 |
p. 749-756
|
artikel
|
| 18 |
Predicting the efficiencies of 2-mercaptobenzothiazole collectors used as chelating agents in flotation processes: a density-functional study
|
Yekeler, Hülya
|
|
2006
|
12 |
6 |
p. 763-768
|
artikel
|
| 19 |
QSAR modeling of AT1 receptor antagonists using ANN
|
Su, Qing
|
|
2006
|
12 |
6 |
p. 869-875
|
artikel
|
| 20 |
Reverse-docking study of the TADDOL-catalyzed asymmetric hetero-Diels–Alder reaction
|
Harriman, D. Joseph
|
|
2006
|
12 |
6 |
p. 793-797
|
artikel
|
| 21 |
Structural insights into the effect of isonucleosides on B-DNA duplexes using molecular-dynamics simulations
|
Jin, Hongwei
|
|
2006
|
12 |
6 |
p. 781-791
|
artikel
|
| 22 |
Structural insights into the effect of isonucleosides on B-DNA duplexes using molecular-dynamics simulations
|
Jin, Hongwei
|
|
|
12 |
6 |
p. 781-791
|
artikel
|
| 23 |
Structural model of an antistasin/notch-like fusion protein from the cocoon wall of the aquatic leech, Theromyzon tessulatum
|
Mason, Tarin A.
|
|
2006
|
12 |
6 |
p. 829-834
|
artikel
|
| 24 |
Structure–olfactive threshold relationships for pyrazine derivatives
|
Zakarya, Driss
|
|
2006
|
12 |
6 |
p. 985-989
|
artikel
|
| 25 |
Structures of inclusion complexes of halogenbenzoic acids and α-cyclodextrin based on AM1 calculations
|
Pumera, Martin
|
|
2006
|
12 |
6 |
p. 799-803
|
artikel
|
| 26 |
Study of the influence of temperature on the dynamics of the catalytic cleft in 1,3-1,4-β-glucanase by molecular dynamics simulations
|
Gargallo, Raimundo
|
|
2006
|
12 |
6 |
p. 835-845
|
artikel
|
| 27 |
Theoretical study of [ XN5 ]− (X=O, S, Se, Te) systems
|
Cheng, Li Ping
|
|
2006
|
12 |
6 |
p. 805-811
|
artikel
|
| 28 |
The structure of 5a,6–anhydrotetracycline and its Mg2+ complexes in aqueous solution
|
Othersen, Olaf G.
|
|
2006
|
12 |
6 |
p. 953-963
|
artikel
|
| 29 |
The use of classification methods for modeling the antioxidant activity of flavonoid compounds
|
Weber, Karen C.
|
|
2006
|
12 |
6 |
p. 915-920
|
artikel
|
| 30 |
Three-dimensional model of zeaxanthin binding PsbS protein associated with nonphotochemical quenching of excess quanta of light energy absorbed by the photosynthetic apparatus
|
Haripal, Prafulla K.
|
|
2006
|
12 |
6 |
p. 847-853
|
artikel
|
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