New machine learning and physics-based scoring functions for drug

Frontiers Scoring Functions for Protein-Ligand Binding Affinity

PIGNet2: a versatile deep learning-based protein–ligand

De novo design with deep generative models based on 3D similarity

Improved Prediction Of Ligand-Protein Binding Affinities By Meta-Modeling

Enhancing preclinical drug discovery with artificial intelligence

An Overview of Scoring Functions Used for Protein–Ligand

Pharmaceuticals, Free Full-Text

Pharmaceuticals, Free Full-Text

TB-IECS: an accurate machine learning-based scoring function for

TB-IECS: an accurate machine learning-based scoring function for

AxDrug – AI & Computational Chemistry powered Drug Discovery