Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
TorsionNet: A Deep Neural Network to Rapidly Predict Small Molecule Torsion Energy Profiles with the Accuracy of Quantum Mechanics
, Authors:
Brajesh Rai, Vishnu Sresht, Qingyi Yang, Rayomond J. Unwalla, Meihua Tu, Alan M. Mathiowetz, Gregory A. Bakken
Version 1 posted 24 December 2020
1,252
Downloads