1. Benchmark study on deep neural network potentials for small organic molecules. Issue 5 (6th December 2021) Authors: Modee, Rohit; Laghuvarapu, Siddhartha; Priyakumar, U. Deva Journal: Journal of computational chemistry Issue: Volume 43:Issue 5(2022) Page Start: 308 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. DART: deep learning enabled topological interaction model for energy prediction of metal clusters and its application in identifying unique low energy isomers. Issue 38 (27th September 2021) Authors: Modee, Rohit; Agarwal, Sheena; Verma, Ashwini; Joshi, Kavita; Priyakumar, U. Deva Journal: Physical chemistry chemical physics Issue: Volume 23:Issue 38(2021) Page Start: 21995 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗