Development and testing of a de novo drug-design algorithm.
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- Journal of Computer-Aided Molecular Design, 2003, v. 17, n. 10, p. 621, doi. 10.1023/B:JCAM.0000017362.66268.d5
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- Publication type:
- Article
Works matching IS 0920654X AND DT 2003 AND VI 17 AND IP 10
Results: 7
1
2
Computational models to predict blood–brain barrier permeation and CNS activity.
- Published in:
- Journal of Computer-Aided Molecular Design, 2003, v. 17, n. 10, p. 643, doi. 10.1023/B:JCAM.0000017372.32162.37
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- Publication type:
- Article
3
TOPS-MODE versus DRAGON descriptors to predict permeability coefficients through low-density polyethylene.
- Published in:
- Journal of Computer-Aided Molecular Design, 2003, v. 17, n. 10, p. 665
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- Publication type:
- Article
4
Sampling and convergence in free energy calculations of protein-ligand interactions: The binding of triphenoxypyridine derivatives to factor Xa and trypsin.
- Published in:
- Journal of Computer-Aided Molecular Design, 2003, v. 17, n. 10, p. 673, doi. 10.1023/B:JCAM.0000017374.53591.32
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- Publication type:
- Article
5
Comparison of correlation vector methods for ligand-based similarity searching.
- Published in:
- Journal of Computer-Aided Molecular Design, 2003, v. 17, n. 10, p. 687, doi. 10.1023/B:JCAM.0000017375.61558.ad
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- Publication type:
- Article
6
Relative free energies of binding to thymidylate synthase of 2- and/or 4-thio and/or 5-fluoro analogues of dUMP.
- Published in:
- Journal of Computer-Aided Molecular Design, 2003, v. 17, n. 10, p. 699, doi. 10.1023/B:JCAM.0000017377.07094.2e
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- Publication type:
- Article
7
Corrigendum.
- Published in:
- 2003
- Publication type:
- Correction Notice