Author
Shiv Nadar University
Listed by name: these papers carry no ORCID for this author, so different people with the same name may be mixed together.
3 papers
Recent·Most cited
Satya Pratik Srivastava, Sharath Krishna Chundru, Harshit Singh, Rajeev Kumar Singh
The paper evaluates whether molecular models can causally represent chemical variables by comparing intervention effects with random controls and pretraining advantages.
Satya Pratik Srivastava, Rohan Gorantla, Sharath Krishna Chundru…·Rajeev Kumar Singh
GRASP is a graph Transformer that learns molecular structure from ZINC20 data and adapts to ChEMBL bioactivity, achieving better performance than existing models on ADMET prediction tasks.
Satya Pratik Srivastava, Rohan Gorantla, Sharath Krishna Chundru…·Rajeev Kumar Singh
This paper develops an explainable active learning framework for ligand binding affinity prediction, showing that method choices affect outcomes but dataset characteristics set performance limits.