Iterative machine learning-based chemical similarity search to identify novel chemical inhibitors.
Prasannavenkatesh DuraiSue Jung LeeJae Wook LeeCheol-Ho PanKeunwan ParkPublished in: J. Cheminformatics (2023)
Keyphrases
- similarity search
- machine learning
- distance function
- metric space
- efficient similarity search
- similarity measure
- high dimensional data
- multimedia databases
- high dimensional
- similarity searching
- similarity queries
- similarity retrieval
- query processing
- knn
- cross view
- indexing techniques
- hash functions
- locality sensitive hashing
- neural network
- multimodal data
- metric access methods
- databases
- searching in metric spaces
- nearest neighbor search
- dynamic time warping
- computer vision
- indexing structure
- r tree
- microarray
- moving objects
- data structure
- decision trees
- feature selection