Concepedia

Improved QSARs for predictive toxicology of halogenated hydrocarbons

Steven Trohalaki, Eric Gifford, Ruth Pachter

Computers & Chemistry · 2000 · 44 citations · 13 references

Concepts

PharmacyChemistryToxicologyDrug DesignDrug DiscoveryEnvironmental ToxicologyCarcinogenicity AssessmentChemical Hazard AssessmentChemical Space ExplorationComputational ToxicologyHalogen ChemistryHydrocarbon ToxicityChemical Structure-activity RelationshipsMolecular Property-based Toxicity PredictionPredictive Toxicology ModelsQuantitative Structure-toxicity Relationship ModelingQuantitative Structure-toxicity Relationships

References

13

IARC Monographs on the Evaluation of Carcinogenic Risks to Humans. Overall Evaluations of Carcinogenicity: An Updating of IARC Monographs vol. 1 to 42. Supplement 7. 440 Seiten. International Agency for Research on Cancer, Lyon 1987. Preis: 65, – s.Fr

D. W. R. Bleyl · Food / Nahrung · 1989 · 2.3K citations

Medicine, Oncology, Toxicology +17

Monographs on the Evaluation of Carcinogenic Risks to Humans

Analytica Chimica Acta · 1991 · 1.3K citations

Medicine, Oncology, Toxicology +12

What Do the Kohn−Sham Orbitals and Eigenvalues Mean?

Ralf Stowasser, Roald Hoffmann · Journal of the American Chemical Society · 1999 · 673 citations

Natural Sciences, Chemistry, Physics +16

Development and use of charged partial surface area structural descriptors in computer-assisted quantitative structure-property relationship studies

David T. Stanton, Peter C. Jurs · Analytical Chemistry · 1990 · 649 citations

Natural Sciences, Chemistry, Analytical Chemistry +10

Handbook of Chemical Property Estimation Methods

James T. Stewart · Journal of Pharmaceutical Sciences · 1983 · 582 citations

Natural Sciences, Chemical Engineering, Chemistry +12