Nature

Algorithm selection for protein–ligand docking: strategies and analysis on ACE

The present study investigates the use of algorithm selection for automatically choosing an algorithm for any given protein–ligand docking task. In drug discovery and design process, conceptualizing ...
Nature

A novel two-stage feature selection method based on random forest and improved genetic algorithm for enhancing classification in machine learning

The data acquisition methods are becoming increasingly diverse and advanced, leading to higher data dimensions, blurred classification boundaries, and overfitting datasets, affecting machine learning ...