Electronic structure properties of solvated biomolecules: A quantum approach for macromolecular characterization. - Jana Khandogin; Anguang Hu; Darrin M. York (J. Comput. Chem., 2000)

Machine learning for the prediction of safe and biologically active organophosphorus molecules. - Hang Hu 017; Hsu Kiang Ooi; Mohammad Sajjad Ghaemi; Anguang Hu (Canadian AI, 2023)

bfCHA2: CHemistry Aware Convex Hull Autoencoder Towards Inverse Molecular Design. - Mohammad Sajjad Ghaemi; Hang Hu 017; Anguang Hu; Hsu Kiang Ooi (KI, 2023)

CHA2: CHemistry Aware Convex Hull Autoencoder Towards Inverse Molecular Design. - Mohammad Sajjad Ghaemi; Hang Hu 017; Anguang Hu; Hsu Kiang Ooi (CoRR, 2023)