Identifying the kind behind SMILES - anatomical therapeutic chemical classification using structure-only representations.
Yi CaoZhen-Qun YangXu-Lu ZhangWenqi FanYaowei WangJiajun ShenDong-Qing WeiQing LiXiao-Yong WeiPublished in: Briefings Bioinform. (2022)
Keyphrases
- classification accuracy
- automatic classification
- classification scheme
- pattern classification
- image classification
- machine learning
- classification process
- classification method
- classification algorithm
- support vector machine svm
- pattern recognition
- classification systems
- support vector machine
- medical images
- training set
- classification rate
- support vector
- feature extraction
- three dimensional
- decision trees
- subject specific
- feature space
- data mining
- feature selection
- clustering algorithm
- cost sensitive
- hierarchical structure
- decision rules
- svm classifier
- unsupervised learning
- model selection
- data points
- preprocessing
- feature vectors