Direct De Novo Molecule Generation Using Probabilistic Diverse Variational Autoencoder. - Arun Singh Bhadwal; Kamal Kumar 003 (CVMI, 2022)

GenSMILES: An enhanced validity conscious representation for inverse design of molecules. - Arun Singh Bhadwal; Kamal Kumar 003; Neeraj Kumar 001 (Knowl. Based Syst., 2023)

NRC-VABS: Normalized Reparameterized Conditional Variational Autoencoder with applied beam search in latent space for drug molecule design. - Arun Singh Bhadwal; Kamal Kumar 003; Neeraj Kumar Nehra (Expert Syst. Appl., 2024)

Nc-vae: normalised conditional diverse variational autoencoder guided de novo molecule generation. - Arun Singh Bhadwal; Kamal Kumar 003 (J. Supercomput., 2024)