: A Novel Tool for High-Throughput ADME Property Prediction and Similarity Screening Based on Quantum Chemistry.
Martin HornigAndreas KlamtPublished in: J. Chem. Inf. Model. (2005)
Keyphrases
- high throughput
- microarray
- genome wide
- systems biology
- biological data
- similarity measure
- mass spectrometry data
- genomic data
- data acquisition
- living cells
- mass spectrometry
- proteomic data
- dna sequencing
- protein protein interactions
- biological knowledge
- drug design
- low latency
- virtual screening
- semantic similarity
- machine learning