Docking-based Virtual Screening with Multi-Task Learning.
Zijing LiuXianbin YeXiaoming FangFan WangHua WuHaifeng WangPublished in: CoRR (2021)
Keyphrases
- multi task learning
- virtual screening
- drug discovery
- multi task
- similarity searching
- gaussian processes
- learning tasks
- high throughput
- scoring function
- theoretical analysis
- high order
- learning problems
- binding sites
- inductive learning
- learning models
- similarity search
- transfer learning
- multi class
- feature selection
- learning algorithm
- information retrieval
- markov random field