Ratul Chakraborty

Jaiveer Gill, Ratul Chakraborty, Reetham Gubba et al.

The detailed analysis of molecular structures and properties holds great potential for drug development discovery through machine learning. Developing an emergent property in the model to understand molecules would broaden the horizons for development with a new computational tool. We introduce various methods to detect and cluster chemical compounds based on their SMILES data. Our first method, analyzing the graphical structures of chemical compounds using embedding data, employs vector search to meet our threshold value. The results yielded pronounced, concentrated clusters, and the method produced favorable results in querying and understanding the compounds. We also used natural language description embeddings stored in a vector database with GPT3.5, which outperforms the base model. Thus, we introduce a similarity search and clustering algorithm to aid in searching for and interacting with molecules, enhancing efficiency in chemical exploration and enabling future development of emergent properties in molecular property prediction models.

Isha Rao, Ratul Chakraborty, Sanjay Ghosh

Low-light image denoising and enhancement are challenging, especially when traditional noise assumptions, such as Gaussian noise, do not hold in majority. In many real-world scenarios, such as low-light imaging, noise is signal-dependent and is better represented as Poisson noise. In this work, we address the problem of denoising images degraded by Poisson noise under extreme low-light conditions. We introduce a light-weight deep learning-based method that integrates Retinex based decomposition with Poisson denoising into a unified encoder-decoder network. The model simultaneously enhances illumination and suppresses noise by incorporating a Poisson denoising loss to address signal-dependent noise. Without prior requirement for reflectance and illumination, the network learns an effective decomposition process while ensuring consistent reflectance and smooth illumination without causing any form of color distortion. The experimental results demonstrate the effectiveness and practicality of the proposed low-light illumination enhancement method. Our method significantly improves visibility and brightness in low-light conditions, while preserving image structure and color constancy under ambient illumination.