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QUANTUM CHEMICAL PREDICTION OF ADME-Tox PROPERTIES

Year: 2006
Type: conference-paper
Abstract: ADME-Tox properties are very important in pharmaceutical research, determining the fate of many molecules in the drug design sequence.Knowledge of ADME-Tox properties in the earliest stages of drug design is therefore highly desirable.The aim of this investigation is to construct low throughput in silico models in which ADME-Tox properties of single compounds are predicted with high accuracy using quantum chemical descriptors.
Language: English
Subfield: Drug Discovery
Open Access status: green
OpenAlex ID: W2299304759
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