2 papers
cs.LG2019
Transfer Learning Using Ensemble Neural Networks for Organic Solar Cell Screening
Arindam Paul, Dipendra Jha, Reda Al-Bahrani +3
Organic Solar Cells are a promising technology for solving the clean energy crisis in the world. However, generating candidate chemical compounds for solar cells is a time-consumin…
cs.LG2018
CheMixNet: Mixed DNN Architectures for Predicting Chemical Properties using Multiple Molecular Representations
Arindam Paul, Dipendra Jha, Reda Al-Bahrani +3
SMILES is a linear representation of chemical structures which encodes the connection table, and the stereochemistry of a molecule as a line of text with a grammar structure denoti…