LEADD: Lamarckian evolutionary algorithm for de novo drug design.
Alan KerstjensHans De WinterPublished in: J. Cheminformatics (2022)
Keyphrases
- drug design
- evolutionary algorithm
- optimization problems
- protein structure prediction
- function optimization
- protein protein interactions
- drug discovery
- clonal selection algorithm
- simulated annealing
- crossover operator
- memetic algorithm
- quantitative structure activity
- genetic algorithm
- mutation operator
- human genome
- sequence data
- protein sequences