Energy-based tuning of metaheuristics for molecular docking on multi-GPUs.
Jesús Pérez SerranoBaldomero ImbernonJosé M. CeciliaManuel UjaldonPublished in: Concurr. Comput. Pract. Exp. (2018)
Keyphrases
- particle swarm optimization
- genetic algorithm
- general purpose
- metaheuristic
- drug discovery
- combinatorial optimization
- molecular dynamics
- gpu implementation
- dna computing
- path relinking
- initial solution
- graphics processing units
- parallel processing
- tabu search
- optimization problems
- special case
- optimal solution
- case study