Andy Jiang

Andy Jiang

NASA Johnson Space Center - Houston / United States
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 5580051
person_outline Andy Jiang's MOST POPULAR ARTICLES
1-) Electron-passing neural networks for atomic charge prediction in systems with arbitrary molecular chargeDP Metcalf, A Jiang, SA Spronk, DL Cheney, CD SherrillJournal of Chemical Information and Modeling 61 (1), 115-122, 2020312020
2-) Tensor hypercontraction form of the perturbative triples energy in coupled-cluster theoryA Jiang, JM Turney, HF Schaefer IIIJournal of Chemical Theory and Computation 19 (5), 1476-1486, 202332023
3-) Directional ΔG Neural Network (DrΔG-Net): A Modular Neural Network Approach to Binding Free Energy PredictionDP Metcalf, ZL Glick, A Bortolato, A Jiang, DL Cheney, CD SherrillJournal of Chemical Information and Modeling 64 (6), 1907-1918, 202432024
4-) Accurate and efficient open-source implementation of domain-based local pair natural orbital (DLPNO) coupled-cluster theory using a t1-transformed HamiltonianA Jiang, ZL Glick, D Poole, JM Turney, CD Sherrill, HF SchaeferThe Journal of Chemical Physics 161 (8), 202412024
5-) A modular, composite framework for the utilization of reduced-scaling Coulomb and exchange construction algorithms: Design and implementationD Poole, DB Williams-Young, A Jiang, ZL Glick, CD SherrillThe Journal of Chemical Physics 161 (5), 202412024