Academic
Related Publications
- 2012 vICGM 3 Collaborative Data Sharing.pdf
- 2012 virtual ICGM 8 Sarah.pdf
- 2012 virtual ICGM6 ToxML.pdf
- A knowledge-based approach to the in silico assessment of toxicity .pdf
- A practical application of two in silico systems for identification of potentially mutagenic impurities
- A Tool to Assist Toxicological Knowledge Development by Mining Emerging Patterns from Toxic.pdf
- Adding In Vivo Mammalian Cytogenetics Data to SEND and ToxML.pdf
- Adverse Outcome Pathways for Developmental Toxicity.pdf
- An Approach Toward the Prediction of Chemical Degradation Pathways.pdf
- An evaluation of in-house and off-the-shelf in silico models: Implications on guidance for mutagenicity assessment
- An Expert System To Predict the Forced Degradation of Organic Molecules
- An In Silico Approach To The Prediction Of S-Oxides Of Benzothiophenes, Dibenzothiophenes And Other Sulphur Heterocycles
- An in Silico Method for Predicting Ames Activities of Primary Aromatic Amines
- An introduction to Lhasa Limited and Derek Nexus 180413.pdf
- Analysis of human and in vivo data for hepatotoxicity modelling
- Application and Development of Negative Predictions in Derek.pdf
- Assessing Confidence in Predictions.wmv
- Biotransformation Pathways of Biocides and Pharmaceuticals in Freshwater Crustaceans
- Building an Expert Computer System to Predict Degradation Pathways
- Collaborative Solutions to ICH M7.pdf
- Combined Use of a Database and an Expert System as an In Silico Tool for Predicting Toxicity.pdf
- Comparative Evaluation of in Silico Systems for Ames Test Mutagenicity Predict.pdf
- Defining Applicability Domains for Structural Alerts for Mutagenicity.pdf
- Developing Biotransformations to Predict the Cytochrome P450 Oxidative and Reductive Dehalogenation of Haloanilines and Haloethanes
- Developing Structure-Activity Relationships for the Prediction of Hepatotoxicity
- Development of Structure-Activity Relationships for Hepatotoxicity Using Proprietary Data.pdf
- Excipients data sharing initiative a step towards 3-R principle implementation.pdf
- Expert Systems - The Use of Expert Systems in Drug Design-Toxicity and Metabolism
- Food for thought - A toxicology ontology roadmap
- Giving Confidence for in silico GTI Assessment.pdf
- How To - Filtering Mass Defect
- In Silico Systems For The Prediction Of Toxicity
- Introduction to in silico toxicology
- Sarah Nexus Batch Prediction Tutorial
- MIP-DILI Introduction Poster
- MIP-DILI Project Overview
- Evaluation Of A Statistics-based Ames Mutagenicity QSAR Model And Interpretation Of The Results Obtained
- It’s difficult, but important, to make negative predictions
- Predicting skin sensitisation using a decision tree integrated testing strategy with an in silico model and in chemico/in vitro assays
- Mutagenicity assessment strategy for pharmaceutical intermediates to aid limit setting for occupational exposure
- 38th ICGM Product Update.pdf
- Benchmarking Assessment of Salmonella Mutagenicity QSAR Models for Potential Use Under ICH M7.pdf
- Can public data improve mutagenicity predictions for proprietary compounds.pdf
- Building models of bacterial mutagenicity from biased training data.pdf
- Analysis of human and in vivo data for hepatotoxicity modelling.pdf
- Adverse outcome pathways for the nephrotoxicity of non-steroidal anti-inflammatory drugs.pdf
- Computational Approaches to Managing Mutagenicity Risk for ICH M7 and Beyond.pdf
- Building Models within Sarah Nexus.pdf
- Derek Nexus and Sarah Nexus - working together for ICH M7.pdf
- Improving xenobiotic metabolite ranking
- 43rd ICGM Product Update
- Structure Guided Design and Optimization of Selective Kinase Inhibitors from Fragment Starting Points
- Practical Implementation of (Q)SAR and Expert Review for Compliance with ICH M7 Guidelines
- Guiding Compound Design in 2,3...N Dimensions
- Effective use of experiment modeling for the capture and analysis of results in DMPK/ADME
- Harnessing comprehensive small molecule project data to inform design and decisions
- Predicting the Purging of Impurities within an API Synthetic Pathway
- Speeding up and improving the Identification of a potent ß2 agonist as a growth promoter for cattle
- Improvements to in silico predictivity after access to proprietary data
- Summation of Toxicity Data in Vitic
- Derek for Windows - an example of a Knowledge-Based Prediction System.pdf
- ICH M7 - Worked Examples using the new Nexus workflow
- Assessing confidence in predictions made by knowledge-based systems
- The Liability Load and how Lhasa Limited Focuses on Reducing it
- Meteor Nexus: The implementation of the site of metabolism prediction methodology
- Workbook: Expert Review of EC3 Predictions - a workshop
- Sarah Nexus: The Statistical System for ICH M7
- An Overview of Lhasa Limited Collaborative Data Sharing Initiatives
- Interpretation and mining of statistical machine learning (Q)SAR models for toxicity prediction
- Lhasa Data Sharing Experience at Bristol-Myers Squibb
- Nexus 2.2: An Overview of Key New Features - Derek and Meteor Nexus
- Strain profiles: Moving beyond binary Ames classification
- Addressing the Challenge of Making Negative Predictions for Skin Sensitisation
- Derek Nexus and the Prediction of Human Skin Sensitisation Potential: An Evaluation
- Sarah Nexus Strain Information
- Developing an adverse outcome pathway framework for carcinogenicity from alerts in an expert rule-based system
- Zeneth: an in silico tool to aid identification of degradants
- Enhancing the ICH M7 Workflow through Setaria
- Important considerations for the validation of QSAR models for in vitro mutagenicity
