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Mohit Kumar

affiliation not provided to SSRN

  • affiliation not provided to SSRN

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ML-VSPred: An Interpretable Machine Learning Model for Binding Affinity Prediction and Virtual Screening of Plant-Based Bioactive Compounds

Number of pages: 1904 Posted: 25 Apr 2026
Nimai Charan Mahanandia, Satyaranjan Biswal, Mohit Kumar, Mohammad Samir Farooqi, Sudhir Srivastava, Dwijesh Chandra Mishra, Krishna Kumar Chaturvedi, Anu Sharma, Sneha Murmu and Girish K. Jha
affiliation not provided to SSRN, Hebrew University of Jerusalem, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, affiliation not provided to SSRN, Government of India - Indian Council of Agricultural Research and Indian Council of Agricultural Research (ICAR) - Division of Agricultural Economics
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ML-VSPred, XGBoost, PDBbind v2020, SHAP interpretability, drug discovery