Flux (2): Comparison of Molecular Mutation and Crossover Operators for Ligand-Based de Novo Design.

Uli Fechner Gisbert Schneider

Published in: J. Chem. Inf. Model. (2007)

Keyphrases

crossover operator
evolutionary algorithm
differential evolution
genetic algorithm
mutation operator
design process
drug discovery
molecular dynamics
neural network
multi objective
optimization algorithm
high throughput
traveling salesman problem