Is molecular alignment an indispensable requirement in the MIA-QSAR method?
Stephen J. BarigyeMatheus P. FreitasPublished in: J. Comput. Chem. (2015)
Keyphrases
- high accuracy
- preprocessing
- significant improvement
- genetic algorithm
- three dimensional
- high precision
- detection method
- support vector machine svm
- optimization method
- neural network
- classification method
- optimization algorithm
- probabilistic model
- computational cost
- experimental evaluation
- prior knowledge
- pairwise
- objective function
- similarity measure
- learning algorithm