De Novo Drug Design

Towards de Novo Drug Design for the Coronavirus: A Drug-Target Interaction Prediction Approach Using Atom-Enhanced Graph Neural Network with Multi-Hop Gating Mechanism

For humans, the COVID-19 pandemic and Coronavirus have undeniably been a nightmare. Although there are effective vaccines, specific …

Duc Q. Nguyen, Khoan D. Le, Bach T. Ly, An D. Nguyen, Quang H. Nguyen, Tuan H. Nguyen, Cuong Quoc Duong, Thanh N. Truong, Phuong Thuy Viet Nguyen, Tho T. Quan