Concepedia

Modeling and prediction by using WHIM descriptors in QSAR studies: submitochondrial particles (SMP) as toxicity blosensors of chlorophenols

Roberto Todeschini, Cinzia Bettiol, G. Giurin, Paola Gramatica, P. Miana, Emanuele Argese

Chemosphere · 1996 · 42 citations · 21 references

Concepts

PharmacyChemistryToxicologyDrug DesignDrug DiscoveryMechanisms Of ToxicityMolecular DescriptorsMolecular Mechanisms Of ToxicityQuantitative Structure-activity RelationshipsComputational Cytotoxicity PredictionComputational Structure-activity ModelingDrug Toxicity PredictionIn Silico Toxicity PredictionMolecular Property-based Toxicity PredictionPredictive Toxicology ModelsQuantitative Structure-toxicity Relationship ModelingQuantitative Structure-toxicity Relationships

References

21

Genetic algorithms as a strategy for feature selection

Riccardo Leardi, Raffaella Boggia, M. Terrile · Journal of Chemometrics · 1992 · 824 citations

Computing, Computer Science, Design Optimization +12

Molecular Connectivity in Structure–activity Analysis

Stefan Unger · Journal of Pharmaceutical Sciences · 1987 · 632 citations

Pharmacy, Biochemistry, Medicinal Chemistry +14

New molecular descriptors for 2D and 3D structures. Theory

Roberto Todeschini, Marina Lasagni, Emilio Marengo · Journal of Chemometrics · 1994 · 300 citations

Natural Sciences, Chemistry, Computational Chemistry +16

Relation between physicochemical properties of phenols and their toxicity and accumulation in fish

Juhani Saarikoski, Matti Viluksela · Ecotoxicology and Environmental Safety · 1982 · 199 citations

Veterinary Medicine, Fisheries, Toxicology +12

Effects of selected chemicals to photoluminescent bacteria and their correlations with acute and sublethal effects on other organisms

Juan M. Ribo, Klaus L.E. Kaiser · Chemosphere · 1983 · 148 citations

Life Sciences, Microbiology, Toxicology +14