MUMBAI, India, Aug. 24 -- Intellectual Property India has published a patent application (202621082036 A) filed by Symbiosis International Deemed University on July 02, 2026, for Integrated System For Smiles Generation And Molecular Property Prediction.
Inventors include Nachiket Ropia; Kaustubh Raykar; Arjun Tyagi; Priyanka V. Deshmukh; Dr. Aniket K. Shahade; and Dr. Shruti Patil.
The application for the patent was published on August 21, 2026, under issue no. 34/2026.
Abstract: ABSTRACT INTEGRATED SYSTEM FOR SMILES GENERATION AND MOLECULAR PROPERTY PREDICTION The present invention provides an integrated system (100) and method for molecular SMILES generation and property prediction. The system (100) comprises a data acquisition and preprocessing module (110), a variational autoencoder module (120) with a GRU-based encoder (122), latent space (124), and decoder (126), a generative adversarial network module (130) with an LSTM-based generator (132) and bidirectional LSTM discriminator (134), a molecular graph conversion module (140), a graph neural network property prediction module (150) comprising a graph convolutional network (152) and graph isomorphism network (154), a post-processing and validation module (160), and an evaluation module (170). The system (100) enables end-to-end molecular discovery by generating novel chemically valid SMILES strings and predicting their physicochemical properties, thereby accelerating computational molecular design. [
Disclaimer: Curated by HT Syndication.
