Bhuvanesh Sridharan

Deep Reinforcement Learning for Molecular Inverse Problem of Nuclear Magnetic Resonance Spectra to Molecular Structure

Bhuvanesh Sridharan, Sarvesh Mehta, Yashaswi Pathak et al. · The Journal of Physical Chemistry Letters · 2022 · 33 citations

Natural Sciences, Chemistry, Physics +17

PLAS-5k: Dataset of Protein-Ligand Affinities from Molecular Dynamics for Machine Learning Applications

Divya B. Korlepara, C. S. Vasavi, Shruti Jeurkar et al. · Scientific Data · 2022 · 25 citations · Full text

Pharmacy, Bioinformatics, Medicinal Chemistry +17

Efficient and enhanced sampling of drug‐like chemical space for virtual screening and molecular design using modern machine learning methods

Manan Goel, Rishal Aggarwal, Bhuvanesh Sridharan et al. · Wiley Interdisciplinary Reviews Computational Molecular Science · 2022 · 24 citations

Pharmacy, Chemistry, Medicinal Chemistry +15

DeepSPInN – deep reinforcement learning for molecular structure prediction from infrared and ¹³ C NMR spectra

Sriram Devata, Bhuvanesh Sridharan, Sarvesh Mehta et al. · Digital Discovery · 2024 · 17 citations · Full text

Natural Sciences, Chemistry, Physics +17