Peer-reviewed publications

• ToxCast EPA in vitro to in vivo challenge: Insight into Rank-I model
• Consensus modeling for HTS assays using in silico descriptors calculates the best balanced accuracy in Tox21 challenge
• CERAPP: Collaborative Estrogen Receptor Activity Prediction Project
• A k-Nearest Neighbor Classification of HERG K+ Channel Blockers
• Using Online Tool (iPrior) for Modeling ToxCast™ Assays Towards Prioritization of Animal Toxicity Testing
• Prediction-driven matched molecular pairs to interpret QSARs and aid the molecular optimization process
• Persistence and dioxin-like toxicity of carbazole and chlorocarbazoles in soil
• The QSPR-THESAURUS: The online platform of the CADASTER project
• Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information

Talks and invited lectures

• Machine-learning applications in clinical research, (Technical University of Munich, GRK Seminar, May 2016)
• Tox21 Challenge To Build Predictive Models of Nuclear Receptor and Stress-Response Pathways As Mediated by Exposure to Environmental Toxicants and Drugs, (SOT New Orleans, March 2016)
• The AOP community outreach – AOP-XML: A format standard between AOP-KB modules and interested third parties, (OpenTox Basel, March 2016)
• QSAR modeling for the evaluation of Aryl Hydrocarbon receptor activators; and Analyzing Toxcast Phase I HTS assays as a potential descriptors (ECO closing conference, September 2013)
• SAR in the cloud; OCHEM, a free online platform for modeling and interpretation (EPFL Workshop on chemical information, August 2013)
• QSAR modeling for the evaluation of Aryl hydrocarbon receptor activators (244th ACS meeting, August 2012)
• Combining HTS in vitro assays with in silico descriptors for liver toxicity modeling (244th ACS meeting, August 2012)
• Karl-Franzens-Universität Graz, Inst. Fur Pharmazeutische Wissenschaften Bereich Pharmazeutische Chemie, Graz, Austria
• Drug design summer school 2007 & 2008 – Tuebingen, Germany