An Optimization Method for Drug Design Based on Molecular Features.
Xuan LiuXiaoli LinFengli ZhouPublished in: ICIC (LNBI 1) (2024)
Keyphrases
- optimization method
- drug design
- optimization algorithm
- optimization methods
- optimization process
- genetic algorithm
- evolutionary algorithm
- drug discovery
- particle swarm
- protein structure prediction
- nelder mead simplex
- search algorithm
- simulated annealing
- data collection
- multi objective
- metaheuristic
- feature space
- protein protein interactions
- optimization procedure
- machine learning
- quantitative structure activity