Tool for directed evolution of protein receptors specifically for a ligand of interest ; implementation and fine-tuning of @zaixizhang 's PocketGen focused on maximizing binding affinity.

Workshop on the preparation, execution, and analysis of protein molecular dynamics simulations

Coordenado pelo Prof.º Dr. Kelson Mota Teixeira de Oliveira. Laboratório de Química Teórica e Computacional (LQTC) - Departamento de Química - Instituto de Ciências Exatas (ICE) - Universidade Federal do Amazonas (UFAM)