GP-477 Published Papers: 21, View All NIPER Publications
1	Agarwal D, Sharma A, Garg P. Graph-Based Classification with GNN-Explainer for Predicting Cardiac Toxicity Associated with Multi-Ion Channel Blockers. Chemical Research in Toxicology 2026, 39: 518-529.
2	Manchanda K, Ranjan S, Singh T, Bharatam PV. Nitrenium ion ↔ nitreone resonance in fused cyclic five-membered triazolium ions (fCFTIs): a quantum chemical study. Physical Chemistry Chemical Physics 2026, 28: 2331-2343.
3	Ali A, Begam S, Mehta K, Bharatam PV, Khan AT. Regioselective Synthesis of (E)-3-((Alkylamino)methylene)-2-thioxothiochroman-4-one Derivatives and Their Regioselective Cycloaddition with Alkynes. Journal of Organic Chemistry 2025, 90: 8857-8868.
4	Gupta P, Sharma VK, Garg P. Pharmacoinformatics-based identification of dual inhibitors of leishmanial DHFR and PTR1 enzymes. Letters in Drug Design & Discovery 2025, : 100197.
5	Jain R, Mungamuri SK, Garg P. Redefining Precision Medicine in Hepatocellular Carcinoma through Omics, Preclinical, and AI-based Innovations. The Journal of Precision Medicine: Health and Disease 2025, 1: 100003.
6	Kamble P, Dubey K, Mukherjee A, Jain R, Roy I, Puri V, Garg P. Decoding Cervical Cancer Biomarkers: An Integrated Framework of Bioinformatics, Machine Learning, and Experimental Confirmation. Cancer Investigation 2025, 43: 882-902.
7	Kamble P, Sandhu H, Puri V, Sharma A, Garg P. Integrative Bioinformatics, Statistical, and Survival Analysis Reveals Potential Molecular Biomarkers of Ovarian Cancer. Egyptian Journal of Medical Human Genetics 2025, 26: 152.
8	Kamble P, Sharma A, Banerjee A, Pandey S, Garg P. Proteintox: A Multifaceted Machine Learning Strategy for Identifying Cardiotoxic, Neurotoxic, and Enterotoxic Proteins. Computational Toxicology 2025, 36: 100390.
9	Kamble P, Varma T, Kumar R, Garg P. Computational Theranostics Strategy for Pancreatic Ductal Adenocarcinoma. Molecular Diversity 2025, DOI:10.1007/s11030-025-11241-3.
10	Kumari M, Chauhan R, Garg P. Can LLMs Revolutionize Text Mining in Chemistry? A Comparative Study with Domain-Specific Tools. Computer Standards & Interfaces 2025, 94: 103997.
11	Kumari M, Chauhan R, Garg P. MedKG: Enabling Precision Medicine through a Unified Biomedical Knowledge Graph. Molecular Diversity 2025, 29: 3465-3483.
12	Kumari M, Garg P. Enhanced Chemical Reaction Mining through Combined Model Adaptation and Prompt Engineering. Journal of Chemical Information and Modeling 2025, 65: 10348-10363.
13	Manchanda K, Patra N, Dayare LN, Bharatam PV. Exploring the Electronic Properties of Cyclic Five-Membered 1,2,3-Triazolium Ions: A Quantum Chemical Study. Journal of Physical Chemistry. A 2025, 129: 4654-4666.
14	Mukhopadhyay J, Rana S, Gupta A, Bharatam PV. (Carbene) → SO(2) complexes: ligand-stabilised carbocyclic carbenes (lsCCCs) are better than N-heterocyclic carbenes. Dalton Transactions 2025, 54: 9701-9713.
15	Rajesh K, Sharma A, Garg P. Diagnosing Respiratory Variability: Convolutional Neural Networks for Chest X-Ray Classification Across Diverse Pulmonary Conditions. Journal of Imaging Informatics in Medicine 2025, 38: 2677-2687.
16	Rajkumar R, Sharma A, Badade A, Varma T, Garg P. OpioidBias: A Machine Learning Framework for Predicting Biased Agonism of Opioid Ligands. ACS Medicinal Chemistry Letters 2025, 16: 2467-2476.
17	Sharma A, Diwakar V, Kumar R, Garg P. Enzyme classification integrating LSTM and Prot-BERT sequence encoding. Applied Soft Computing 2025, 184: 113774.
18	Varma T, Kamble P, Rajkumar R, Garg P. Computational discovery of ATP-competitive GSK3β inhibitors using database-driven virtual screening and deep learning. Molecular Diversity 2025, DOI:10.1007/s11030-025-11320-5.
19	Wani MA, Banerjee A, Garg P. Computer-Aided Drug Design Approaches for the Identification of Potent Inhibitors Targeting Elongation Factor G of Mycobacterium tuberculosis. Journal of Molecular Graphics and Modelling 2025, 136: 108954.
20	Banerjee A, Sharma A, Kamble P, Garg P. Prediction of Mtb cell wall permeability using Machine Learning Methods. Molecular Diversity 2024, 28: 2317-2329.
21	Wankhade N, Sharma A, Wani MA, Banerjee A, Garg P. Predictive Modelling and Drug Repurposing for Type-II Diabetes. ACS Medicinal Chemistry Letters 2024, 15: 1907-1917.