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Works matching IS 0920654X AND DT 2005 AND VI 19 AND IP 3

Results: 5

1

Towards the chemometric dissection of peptide – HLA-A*0201 binding affinity: comparison of local and global QSAR models.

Published in:

Journal of Computer-Aided Molecular Design, 2005, v. 19, n. 3, p. 203, doi. 10.1007/s10822-005-3993-x

By:

Doytchinova, Irini;
Walshe, Valerie;
Borrow, Persephone;
Flower, Darren

Publication type:

Article

2

A support vector machine approach to classify human cytochrome P450 3A4 inhibitors.

Published in:

Journal of Computer-Aided Molecular Design, 2005, v. 19, n. 3, p. 189, doi. 10.1007/s10822-005-3785-3

By:

Kriegl, Jan;
Arnhold, Thomas;
Beck, Bernd;
Fox, Thomas

Publication type:

Article

3

Multiple ligand-binding modes in bacterial R67 dihydrofolate reductase.

Published in:

Journal of Computer-Aided Molecular Design, 2005, v. 19, n. 3, p. 165, doi. 10.1007/s10822-005-3693-6

By:

Alonso, Hernán;
Gillies, Malcolm;
Cummins, Peter;
Bliznyuk, Andrey;
Gready, Jill

Publication type:

Article

4

Molecular design of two sterol 14α-demethylase homology models and their interactions with the azole antifungals ketoconazole and bifonazole.

Published in:

Journal of Computer-Aided Molecular Design, 2005, v. 19, n. 3, p. 149, doi. 10.1007/s10822-005-3692-7

By:

Rupp, Bernd;
Raub, Stephan;
Marian, Christel;
Höltje, Hans-Dieter

Publication type:

Article

5

An in silico approach for screening flavonoids as P-glycoprotein inhibitors based on a Bayesian-regularized neural network.

Published in:

Journal of Computer-Aided Molecular Design, 2005, v. 19, n. 3, p. 137, doi. 10.1007/s10822-005-3321-5

By:

Wang, Yong-Hua;
Li, Yan;
Yang, Sheng-Li;
Yang, Ling

Publication type:

Article