1. BAND NN: A Deep Learning Framework for Energy Prediction and Geometry Optimization of Organic Small Molecules. Issue 8 (17th December 2019) Authors: Laghuvarapu, Siddhartha; Pathak, Yashaswi; Priyakumar, U. Deva Journal: Journal of computational chemistry Issue: Volume 41:Issue 8(2020) Page Start: 790 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Deep learning enabled inorganic material generator. Issue 46 (18th November 2020) Authors: Pathak, Yashaswi; Juneja, Karandeep Singh; Varma, Girish; Ehara, Masahiro; Priyakumar, U. Deva Journal: Physical chemistry chemical physics Issue: Volume 22:Issue 46(2020) Page Start: 26935 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. MEMES: Machine learning framework for Enhanced MolEcular Screening. Issue 35 (5th August 2021) Authors: Mehta, Sarvesh; Laghuvarapu, Siddhartha; Pathak, Yashaswi; Sethi, Aaftaab; Alvala, Mallika; Priyakumar, U. Deva Journal: Chemical science Issue: Volume 12:Issue 35(2021) Page Start: 11710 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗