Validation of the Generalized Force Fields GAFF, CGenFF, OPLS-AA, and PRODRGFF by Testing Against Experimental Osmotic Coefficient Data for Small Drug-Like Molecules | Journal of Chemical Information and Modeling
Novel computational models offer alternatives to animal testing for assessing eye irritation and corrosion potential of chemicals - ScienceDirect
Article Reference
PDF) Novel computational models offer alternatives to animal testing for assessing eye irritation and corrosion potential of chemicals
Computational resources in healthcare - Sharma - - WIREs Data Mining and Knowledge Discovery - Wiley Online Library
Exploring Cheminformatic Toolsets for Predicting the Dermal Toxicity of Furanocoumarins
In silico prediction of toxicity and its applications for chemicals at work | SpringerLink
Novel computational models offer alternatives to animal testing for assessing eye irritation and corrosion potential of chemicals - ScienceDirect
Exploring Cheminformatic Toolsets for Predicting the Dermal Toxicity of Furanocoumarins – тема научной статьи по фундаментальной медицине читайте бесплатно текст научно-исследовательской работы в электронной библиотеке КиберЛенинка
Frontiers | In silico Prediction of Skin Sensitization: Quo vadis?
An Overview of Molecular Modeling for Drug Discovery with Specific Illustrative Examples of Applications. - Abstract - Europe PMC
Exploring Cheminformatic Toolsets for Predicting the Dermal Toxicity of Furanocoumarins – тема научной статьи по фундаментальной медицине читайте бесплатно текст научно-исследовательской работы в электронной библиотеке КиберЛенинка
In silico assessment of human health risks caused by cyanotoxins from cyanobacteria
PDF) Novel computational models offer alternatives to animal testing for assessing eye irritation and corrosion potential of chemicals
Computational Modeling on Aquaporin-3 as Skin Cancer Target: A Virtual Screening and Molecular Dynamic Simulation Study
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Reparametrization of Protein Force Field Nonbonded Interactions Guided by Osmotic Coefficient Measurements from Molecular Dynamics Simulations | Journal of Chemical Theory and Computation
In silico assessment of human health risks caused by cyanotoxins from cyanobacteria
Identification of Fatty Acid Binding Protein 5 Inhibitors Through Similarity-Based Screening. - Abstract - Europe PMC
Computational Modeling on Aquaporin-3 as Skin Cancer Target: A Virtual Screening and Molecular Dynamic Simulation Study
STopTox: An in Silico Alternative to Animal Testing for Acute Systemic and Topical Toxicity | Environmental Health Perspectives | Vol. 130, No. 2
Frontiers | In silico Assessment of Pharmacological Profile of Low Molecular Weight Oligo-Hydroxyalkanoates
Multi-Descriptor Read Across (MuDRA): A Simple and Transparent Approach for Developing Accurate Quantitative Structure–Activity Relationship Models | Journal of Chemical Information and Modeling
Trust, but Verify II: A Practical Guide to Chemogenomics Data Curation | Journal of Chemical Information and Modeling
Pred-Skin: A Fast and Reliable Web Application to Assess Skin Sensitization Effect of Chemicals | Journal of Chemical Information and Modeling
