A5101634653- Computational Drug Discovery Methods
- Animal testing and alternatives
- Chemical Safety and Risk Management
- Process Optimization and Integration
- Contact Dermatitis and Allergies
- Analytical Chemistry and Chromatography
- Carcinogens and Genotoxicity Assessment
- Chemistry and Chemical Engineering
- Pesticide Residue Analysis and Safety
- Cholinesterase and Neurodegenerative Diseases
Canary Wharf Group (United Kingdom)
2024
Stratophase (United Kingdom)
2017
Zeneth, a software application for the prediction of chemical degradation small organic molecules, incorporates knowledge base rules to predict pathways. In addition, contains property predictors that modulate predicted likelihood given product. this study, C–H bond dissociation energy (C–H BDE) predictor, which has been integrated into software, was utilized. To determine software's predictive capabilities [using its (2020.1.0 KB)], experimentally derived profiles 25 drug substances were...
Dermal contact with chemicals may lead to an inflammatory reaction known as allergic dermatitis. Consequently, it is important assess new and existing for their skin sensitizing potential mitigate exposure accordingly. There urgent need develop quantitative non-animal methods better predict the potency of sensitizers, driven largely by European Union (EU) Regulation 1223/2009, which forbids use animal tests cosmetic ingredients sold in EU. A Nearest Neighbours silico model was developed...