Using a pharmacophore representation concept to elucidate molecular similarity of dopamine antagonists.
- Published in:
- Journal of Computer-Aided Molecular Design, 2007, v. 21, n. 5, p. 239, doi. 10.1007/s10822-007-9110-6
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- Publication type:
- Article
Works matching IS 0920654X AND DT 2007 AND VI 21 AND IP 5
Results: 5
1
2
TrixX: structure-based molecule indexing for large-scale virtual screening in sublinear time.
- Published in:
- Journal of Computer-Aided Molecular Design, 2007, v. 21, n. 5, p. 223, doi. 10.1007/s10822-007-9103-5
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- Publication type:
- Article
3
Optimization of biaryl piperidine and 4-amino-2-biarylurea MCH1 receptor antagonists using QSAR modeling, classification techniques and virtual screening.
- Published in:
- Journal of Computer-Aided Molecular Design, 2007, v. 21, n. 5, p. 251, doi. 10.1007/s10822-007-9112-4
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- Publication type:
- Article
4
Support vector inductive logic programming outperforms the naive Bayes classifier and inductive logic programming for the classification of bioactive chemical compounds.
- Published in:
- Journal of Computer-Aided Molecular Design, 2007, v. 21, n. 5, p. 269, doi. 10.1007/s10822-007-9113-3
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- Publication type:
- Article
5
Surflex-Dock 2.1: Robust performance from ligand energetic modeling, ring flexibility, and knowledge-based search.
- Published in:
- Journal of Computer-Aided Molecular Design, 2007, v. 21, n. 5, p. 281, doi. 10.1007/s10822-007-9114-2
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- Publication type:
- Article