Finally, WF1448 and WF1419 implemented a more direct approach where a large and diverse library was docked with pharmacophore constraints followed by orthogonal re-scoring. WF1448 used purely physics-based approaches for docking (Glide) and Scoring (HYDE), followed by visual inspection and selection of top compounds by both computational and medicinal chemists. WF1419 used the popular open-source software Vina for docking combined with ML/deep learning scoring functions RF-Score-VS and SCORCHs .