In silico toxicology protocols

Myatt, Glenn J., Ahlberg, Ernst, Akahori, Yumi, Allen, David, Amberg, Alexander, Anger, Lennart T., Aptula, Aynur, Auerbach, Scott, Beilke, Lisa, Bellion, Phillip, Benigni, Romualdo, Bercu, Joel, Booth, Ewan D., Bower, Dave, Brigo, Alessandro, Burden, Natalie, Cammerer, Zoryana, Cronin, Mark T.D., Cross, Kevin P., Custer, Laura, Dettwiler, Magdalena, Dobo, Krista, Ford, Kevin A., Fortin, Marie C., Gad-McDonald, Samantha E., Gellatly, Nichola, Gervais, Véronique, Glover, Kyle P., Glowienke, Susanne, Van Gompel, Jacky, Gutsell, Steve, Hardy, Barry, Harvey, James S., Hillegass, Jedd, Honma, Masamitsu, Hsieh, Jui-Hua, Hsu, Chia-Wen, Hughes, Kathy, Johnson, Candice, Jolly, Robert, Jones, David, Kemper, Ray, Kenyon, Michelle O., Kim, Marlene T., Kruhlak, Naomi L., Kulkarni, Sunil A., Kümmerer, Klaus, Leavitt, Penny, Majer, Bernhard, Masten, Scott, Miller, Scott, Moser, Janet, Mumtaz, Moiz, Muster, Wolfgang, Neilson, Louise, Oprea, Tudor I., Patlewicz, Grace, Paulino, Alexandre, Lo Piparo, Elena, Powley, Mark, Quigley, Donald P., Reddy, M. Vijayaraj, Richarz, Andrea-Nicole, Ruiz, Patricia, Schilter, Benoit, Serafimova, Rositsa, Simpson, Wendy, Stavitskaya, Lidiya, Stidl, Reinhard, Suarez-Rodriguez, Diana, Szabo, David T., Teasdale, Andrew, Trejo-Martin, Alejandra, Valentin, Jean-Pierre, Vuorinen, Anna, Wall, Brian A., Watts, Pete, White, Angela T., Wichard, Joerg, Witt, Kristine L., Woolley, Adam, Woolley, David, Zwickl, Craig, Hasselgren, Catrin·2018·Regulatory Toxicology and Pharmacology
DOI 10.1016/j.yrtph.2018.04.014

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Items 201–240 of 240

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  2. Use of Structure–Activity Relationship (SAR) Evaluation as a Critical Tool in the Evaluation of the Genotoxic Potential of Impurities
    Andrew J. Teasdale · 2021
  3. Compounds identified from the marine Sea Urchin (Diadema savignyi) as Potential Anti-Cancer Drug Candidate against Human Colorectal Cancer: A Bioinformatics Approaches
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  4. Toxicity testing, ‘read-across analysis’
    Hamed Haghi‐Aminjan, Mahban Rahimifard · 2023 · Elsevier eBooks
  5. Mixtures Risk Assessment: Available Methods and Future Directions
    Hana R. Pohl, Melanie C. Buser, Patricia Ruiz, Moiz M. Mumtaz · 2023 · Patty's Toxicology
  6. Genetic Toxicology: Basics and Practical Insights into Its Appropriate Application
    Lynn H. Pottenger, B. Bhaskar Gollapudi, Martha M. Moore · 2023 · Patty's Toxicology
  7. Towards Increased Crop Yields with Molecular Heater Technology
    Vasilios G. Stavros, Jack Matthew Woolley, Natércia d. N. Rodrigues, Josene M. Toldo, Benjamin Rioux, Chris Groves, Xandra Schrama, Jimmy Alarcan, Temitope T. Abiola, Matthieu M. Mention et al. · 2023 · Research Square
  8. Drug review process advancement and required manufacturer and contract research oraganization responses
    Takayuki Anzai, Glenn J. Myatt, Frances C. Hall, B. Finney, Kenshi Nakagawa, Hijiri Iwata, Reo Anzai, Anne Mary Dickinson, Matthew Freer, Dai Nakae et al. · 2023 · Journal of Toxicologic Pathology
  9. Applications of Computational Toxicology in Pharmaceuticals, Environmental and Industrial Practices
    Nidhi Singh, Seema Joshi, Jaya Pandey · 2023 · BENTHAM SCIENCE PUBLISHERS eBooks
  10. How to Neutralize Chemicals that Kill the Environment and Humans: An Application of Computational Toxicology
    Shristi Modanwal, Nidhi Mishra, Ashutosh Mishra · 2023 · BENTHAM SCIENCE PUBLISHERS eBooks
  11. In silico determination of fenthion, permethrin, and carbaryl as FFAR2 inhibitors: Type 2 diabetes mellitus pathomechanism study
    Elly Nurus Sakinah, Nabil Athoillah, Komang Yunita Wiryaning Putri, Yunita Armiyanti · 2023 · Jurnal kedokteran dan kesehatan Indonesia
  12. In Silico Toxicology
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  13. Use of Industrial Scale Chromatography in Pharmaceutical Discovery/Manufacturing
    Gregory Gilmartin · 2024 · Elsevier eBooks
  14. Occupational Toxicology Testing
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  15. A Computational Approach: Predicting iNOS Inhibition of Compounds for Alzheimer's Disease Treatment Through QSAR Modeling
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    Abirami Balakrishnan, Kevin Vinoth, Sowmiya Rajan Jeyakumaran, Varshini Sendhilkumar, Prachi Paharwar, Balakrishnan Paramasivam · 2025 · Environmental Monitoring and Assessment
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    Weihong Lin, Thomas Hill, Andrea M Stroup, Samantha Emma Sarles, Tatsuya Ogura, Farhan Augustine, Sean M. O’Sullivan, Irfan Rahman, Risa J. Robinson, Sairam V. Jabba et al. · 2025 · Toxicological Sciences
  19. Photodegradation of the antibacterial, antifungal and antiprotozoal drug candidate 2-(2-nitrovinyl) furan (G-0) in solid inclusion complexes with β-cyclodextrin derivatives: Characterization by NMR spectroscopy and in silico toxicity screening
    Vivian Ruz Sanjuan, Antonio Gilberto Ferreira, Enoel Hernández Barreto, Guy Van den Mooter, Mirtha Mayra González Bedia, Eryvaldo Sócrates Tabosa do Egito, Anselmo Gomes de Oliveira · 2025 · European Journal of Pharmaceutical Sciences
  20. Framework for In Silico Toxicity Screening of Novel Odorants
    Isaac Mohar, Brad Christopher Hansen, Destiny M. Hollowed, Joel D. Mainland · 2025 · Toxics
  21. In Silico Approaches in Predictive Genetic Toxicology
    Meetali Sinha, Tanya Jamal, Alok Dhawan, Ramakrishnan Parthasarathi · 2025 · Methods in molecular biology
  22. Potential Nutraceuticals Based on In Silico Studies
    Jonelle Brown, Supratik Kar, Mariela Nunez · 2025 · BENTHAM SCIENCE PUBLISHERS eBooks
  23. Development and evaluation of a novel consensus in silico model within the OECD GL497 defined approach for skin sensitization prediction
    Mika Imamura, Ryoichi Murakami, Masakazu Tateshita, Yasushi Hikida · 2026 · Regulatory Toxicology and Pharmacology
  24. Comparative machine learning and deep learning frameworks for robust carcinogenicity prediction and activity cliff analysis
    Arkaprava Banerjee, Vinay Kumar, Kunal Roy · 2026 · Environmental Science Processes & Impacts
  25. Environmental and Human-Health Related Rodent Acute Oral Toxicity Assessment of Aniline Compounds and their Derivatives using QSTR and q-RASTR-based New Approach Methodologies
    Jinxu Li, Shuo Chen, Tengjiao Fan, Ting Ren, Na Zhang, Lijiao Zhao, 钟儒刚, Zhirong Sun, Guohui Sun · 2026 · SSRN Electronic Journal
  26. Redefining the gold standard and recommendations to accelerate the adoption of New Approach Methodologies (NAMs) in support of the Three Rs
    Judith Clare Madden, Steven J. Enoch, Alicia Paini, M Cronin · 2026 · Alternatives to Laboratory Animals
  27. DETERMINATION OF PHYSICOCHEMICAL AND TOXICOLOGICAL PROPERTIES OF AZO DYES USING IN SILICO METHODS
    Gülendam Pirinççi, Şimal Kürümoğlu · 2026 · Kahramanmaraş Sütçü İmam Üniversitesi Mühendislik Bilimleri Dergisi
  28. Intelligent Molecules: A Transformative Roadmap of AI in Drug Discovery
    Hamayat Ali, Sikander Ali, Sibtain Ahmed, Khayala Mammadova, Khaled Fahmi Fawy, Muhammad Arshad · 2026 · ChemistrySelect
  29. Computational toxicology of N -nitrosamine impurities: from molecular structure to regulatory concern
    Rupal Kushwah, Madhavi Kumari, Prabha Garg · 2026 · Toxicology Mechanisms and Methods
  30. Preliminary Risk Assessment of Volatile Organic Compounds Near Industrial Complexes via Prediction of Degradation Products and Potential Toxicity
    Euisung Oh, Eunhwa Choi, Young-Su Lee · 2026 · Journal of Korean Society for Atmospheric Environment
  31. QSAR in the AI Era: Reflections for Advancing Chemical Safety Assessment
    Simona Kovarich, Andrea Gissi, Patience Browne, Mojca Fuart Gatnik, Salvador Moncho, Aleksandra Mostrąg, Glenn J. Myatt, Manuela Pavan, Arianna Bassan · 2026 · Chemical Research in Toxicology
  32. Exposure to perfluorooctanoic acid promotes lung adenocarcinoma: mechanistic insights from multidimensional network analyses
    Jiahong Hong, Xiaoxiang Rong, Jialin Gao, Xiaolin Li, Zetao Zuo, Rui Zhou, Huiying Sun, Zhenhua Huang · 2026 · Environmental Sciences Europe
  33. Advances and evolving methodologies in toxicological research and guidelines in Africa
    Louis Luckmore Gadaga · 2026 · Elsevier eBooks
  34. Development of a consensus in silico tool for the assessment of the endocrine disrupting potential of chemicals for regulatory prioritization
    Orlando Mani, Anne-Laure Demierre, Natalie von Goetz, Sabine Frey · 2026 · Computational Toxicology
  35. Environment and human-health related rodent acute oral toxicity assessment of aniline compounds and their derivatives using QSTR and q-RASTR-based new approach methodologies
    Jinxu Li, Shuo Chen, Tengjiao Fan, Ting Ren, N Zhang, Lijiao Zhao, 钟儒刚, Zhirong Sun, Guohui Sun · 2026 · Journal of Hazardous Materials
  36. Advanced human-relevant in vitro and in silico toxicology approaches as alternatives to animal testing
    Poonam Sahu, Abinash Satapathy, Neha Yadav, Abhisek Satapathy, Trilochan Satapathy · 2026 · The Veterinary Journal Pharmacology & Toxicology
  37. Ecology-by-design: process-level toxicity assessment as the compass for a tox-minimized chemical industry
    Andrey Kolesnikov, Карина Гончарова, Valentine P. Ananikov · 2026 · Reports of NAS RA
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    Arianna Bassan, Alexander Amberg, Maria Letizia Barreca, Paul M. Bradley, Frank Bringezu, Joyce De Paula Souza, C. Guicheney, Elena Lo Piparo, Simona Kovarich, Andrey Massarsky et al. · 2026 · Frontiers in Toxicology
  39. Evaluating the biological effects of caffeine-related compounds methylliberine and theacrine by integrated in silico and in vitro new approach methods (NAMs)
    Michael F. Santillo, Robert L. Sprando, Jeffrey J. Yourick · 2026 · Food and Chemical Toxicology
  40. Explainable AI for Mechanistic Toxicology and Regulatory-Grade Safety Assessment
    Abed Elkareem Alzoubi, Mutaz Khaled Yousef Abdel Wahed, Salma Abdel Wahed · 2026 · Advances in computational intelligence and robotics book series