Publications by authors named "Probir Kumar Ojha"

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An alternative to in vivo/in vitro toxicity testing: Consensus-based prediction for toxicity assessment and prioritisation of diverse chemicals in Japanese eel to safeguard aquatic and public health.
Prodipta Bhattacharyya, Shubha Das, Probir Kumar Ojha

Mar Pollut Bull· January 2026

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Unveiling G protein-coupled inwardly-rectifying potassium channel 4 (GIRK4) inverse agonists: A novel simulation-driven approach leveraging cellular ion flow coupled with chemometrics and protein conformational dynamics.
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha

Int J Biol Macromol· October 2025

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Exploring aquatic toxicity of diverse pesticides against Chironomus riparius (harlequin fly) and Lemna gibba (swollen duckweed): Applications of QSTR, i-QSTTR, and novel q-RA approaches.
Aniket Nath, Probir Kumar Ojha

Sci Total Environ· October 2025

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An alternative to in-vivo/in-vitro drug toxicity testing: Environmentally relevant approaches for toxicity assessment of pharmaceuticals towards rats.
Pabitra Samanta, Ankur Kumar, Probir Kumar Ojha

Chemosphere· October 2025

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Bridging chemistry and toxicology: Chemometric-driven prediction and prioritization of various drugs addressing hazardous effects for human safety.
Shubha Das, Probir Kumar Ojha

J Hazard Mater· September 2025

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Revolutionizing toxicity predictions of diverse chemicals to protect human health: Comparative QSAR and q-RASAR modeling.
Shubha Das, Probir Kumar Ojha

Toxicol Lett· August 2025

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From structure to strategy: chemometric modeling for the prediction of terminal half-life of pharmaceuticals and its role in future therapeutics.
Pabitra Samanta, Shubha Das, Dipika Mandal, Probir Kumar Ojha

Mol Divers· August 2025

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Intelligent consensus prediction for addressing ecotoxicological effects of diverse pesticides on California quail.
Abhisek Samal, Shubha Das, Probir Kumar Ojha

Environ Sci Process Impacts· July 2025

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Risk assessment of industrial chemicals towards salmon species amalgamating QSAR, q-RASAR, and ARKA framework.
Prodipta Bhattacharyya, Shubha Das, Probir Kumar Ojha

Toxicol Rep· June 2025

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Chemometric modeling, inverse docking, and molecular simulations-driven design for multilayered prioritization of novel leishmanicidal agents based on a 2-aminobenzimidazole scaffold.
Arpita Biswas, Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha

Mol Divers· June 2025

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Artificial intelligence to predict inhibitors of drug-metabolizing enzymes and transporters for safer drug design.
Arnab Bhattacharjee, Ankur Kumar, Probir Kumar Ojha, Supratik Kar

Expert Opin Drug Discov· May 2025

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Ligand-based cheminformatics and free energy-inspired molecular simulations for prioritizing and optimizing G-protein coupled receptor kinase-6 (GRK6) inhibitors in multiple myeloma treatment.
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha

Comput Biol Chem· April 2025

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Quantitative read-across structure-property relationship (q-RASPR): a novel approach to estimate the bioaccumulative potential for diverse classes of industrial chemicals in aquatic organisms.
Prodipta Bhattacharyya, Pabitra Samanta, Ankur Kumar, Shubha Das, Probir Kumar Ojha

Environ Sci Process Impacts· January 2025

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First report on chemometrics-driven multilayered lead prioritization in addressing oxysterol-mediated overexpression of G protein-coupled receptor 183.
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha

Mol Divers· December 2024

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First report on regression-based QSAR addressing pesticide dissipation half-life in plants: A step towards sustainable public health.
Ankur Kumar, Probir Kumar Ojha, Kunal Roy

Sci Total Environ· December 2024

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Ecotoxicological risk assessment of active pharmaceutical ingredients (APIs) against different aquatic species leveraging intelligent consensus prediction and i-QSTTR modeling.
Pabitra Samanta, Prodipta Bhattacharyya, Abhisek Samal, Ankur Kumar, Arnab Bhattacharjee, Probir Kumar Ojha

J Hazard Mater· December 2024

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Hazards of antiviral contamination in water: Dissemination, fate, risk and their impact on fish.
Abhigyan Choudhury, Probir Kumar Ojha, Sajal Ray

J Hazard Mater· September 2024

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Safer and greener chemicals for the aquatic ecosystem: Chemometric modeling of the prolonged and chronic aquatic toxicity of chemicals on Oryzias latipes.
Ankur Kumar, Probir Kumar Ojha, Kunal Roy

Aquat Toxicol· August 2024

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Chemometrics-driven prediction and prioritization of diverse pesticides on chickens for addressing hazardous effects on public health.
Shubha Das, Abhisek Samal, Probir Kumar Ojha

J Hazard Mater· June 2024

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Unveiling G-protein coupled receptor kinase-5 inhibitors for chronic degenerative diseases: Multilayered prioritization employing explainable machine learning-driven multi-class QSAR, ligand-based pharmacophore and free energy-inspired molecular simulation.
Arnab Bhattacharjee, Supratik Kar, Probir Kumar Ojha

Int J Biol Macromol· June 2024

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The first report on the assessment of maximum acceptable daily intake (MADI) of pesticides for humans using intelligent consensus predictions.
Ankur Kumar, Probir Kumar Ojha, Kunal Roy

Environ Sci Process Impacts· May 2024

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Chronic aquatic toxicity assessment of diverse chemicals on Daphnia magna using QSAR and chemical read-across.
Ankur Kumar, Vinay Kumar, Probir Kumar Ojha, Kunal Roy

Regul Toxicol Pharmacol· March 2024

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First report on ecotoxicological QSTR and i-QSTR modeling for the prediction of acute ecotoxicity of diverse organic chemicals against three protozoan species.
Ankur Kumar, Vinay Kumar, Trina Podder, Probir Kumar Ojha

Chemosphere· September 2023

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Rottlerin renders a selective and highly potent CYP2C8 inhibition to impede EET formation for implication in cancer therapy.
Diksha Manhas, Shipra Bhatt, Garima Rai, Vinay Kumar, Sahil Bharti, Probir Kumar Ojha

Chem Biol Interact· August 2023

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Computational modeling of aquatic toxicity of polychlorinated naphthalenes (PCNs) employing 2D-QSAR and chemical read-across.
Aniket Nath, Probir Kumar Ojha, Kunal Roy

Aquat Toxicol· April 2023

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