ToxCreate specifications


Unique identifier OMICS_13726
Name ToxCreate
Interface Web user interface
Restrictions to use None
Input data Compound SMILES file, drawn compound, prediction model
Output data Predictive toxicity
Programming languages Java, Javascript
Computer skills Basic
Version 4.0.0
Stability Stable
Maintained Yes



  • person_outline Barry Hardy <>

Publication for ToxCreate

ToxCreate institution(s)
Douglas Connect, Zeiningen, Switzerland; In silico Toxicology, Basel, Switzerland; Ideaconsult Ltd, Sofia, Bulgaria; Istituto Superiore di Sanità, Environment and Health Department, Rome, Italy; Technical University of Munich, Technische Universität München, München, Germany; Albert-Ludwigs University Freiburg, Freiburg, Germany; National Technical University of Athens, School of Chemical Engineering, Zographou, Athens, Greece; David Gallagher, Congresbury, Somerset, UK; Institute of Biomedical Chemistry of Russian Academy of Sciences, Moscow, Russia; Seascape Learning, New Delhi, India; Jawaharlal Nehru University, New Delhi, India; Fraunhofer Institute for Toxicology & Experimental Medicine, Hannover, Germany
ToxCreate funding source(s)
The EU Seventh Framework Program: HEALTH-2007-1.3-3 Promotion, development, validation, acceptance and implementation of QSARs (Quantitative Structure-Activity Relationships) for toxicology, Project Reference Number Health-F5-2008-200787 (2008-2011)

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