Toxicity Detection in Drug Candidates using Simplified Molecular-Input Line-Entry System.
Mriganka NathSubhasish GoswamiPublished in: CoRR (2021)
Keyphrases
- drug discovery
- chemical compounds
- virtual screening
- line detection
- automatic detection
- detection method
- detection algorithm
- drug design
- object detection
- detection accuracy
- curvilinear structures
- three dimensional
- input data
- line segments
- early stage
- line extraction
- detection rate
- straight line
- data sets
- false positives
- anomaly detection
- image sequences
- computer vision