• mGluR5 Related Neurological Diseases
• Method Development for QSAR Ligand-based Virtual Screening
• Novel HTS Datasets composed to benchmark ligand-based QSAR Modeling
• Malaria - Inhibition of beta-Hematin Crystallization in Plasmodium falciparum
• Rapid in silico target identification for anti-malarials

Butkiewicz, M.;Mueller, R., Selic, D., Dawson, E., Meiler, J.
Application of Machine Learning Approaches on Quantitative Structure Activity Relationships (best student paper in IEEE symposium in CIBCB) (2009) In IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology; Wiese

Mueller, R.;Rodriguez, A. L.; Dawson, E. S.; Butkiewicz, M.; Nguyen, T. T.; Oleszkiewicz, S.; Bleckmann, A.; Weaver, C. D.; Lindsley, C. W.; Conn, P. J.; Meiler, J.
Identification of Metabotropic Glutamate Receptor Subtype 5 Potentiators Using Virtual High-Throughput Screening (2010) ACS Chemical Neuroscience

Mariusz Butkiewicz;Edward W. Lowe, Jr., Jens Meiler
Bcl::ChemInfo - Qualitative Analysis Of Machine Learning Models For Activation Of HSD Involved In Alzheimer’s Disease (2012) Proceedings of 2012 IEEE Symposium on Computational Intelligence and Computational Biology

Ralf Mueller;Eric S. Dawson, Colleen M. Niswender, Mariusz Butkiewicz, Corey R. Hopkins, C. David Weaver, Craig W. Lindsley, P. Jeffrey Conn, Jens Meiler
Iterative experimental and virtual high-throughput screening identifies metabotropic glutamate receptor subtype 4 positive allosteric modulators (2012) J Mol Model

Edward W. Lowe, Jr.;Mariusz Butkiewicz, Zollie White III, Matthew Spellings, Albert Omlor, Jens Meiler
Comparative Analysis of Machine Learning Techniques for the Prediction of the DMPK Parameters Intrinsic Clearance and Plasma Protein Binding (2012) Proceedings of 4th International Conference on Bioinformatics and Computational Biology 2012

Edward W. Lowe, Jr.;Mariusz Butkiewicz, Nils Woetzel, Jens Meiler
GPU-Accelerated Machine Learning Techniques Enable QSAR Modeling Of Large HTS Data (2012) Proceedings of 2012 IEEE Symposium on Computational Intelligence and Computational Biology

Greg Sliwoski;Edward W. Lowe, Jr., Mariusz Butkiewicz, Jens Meiler
BCL::EMAS Enantioselective Molecular Asymmetry Descriptor for 3D-QSAR (2012) Molecules

E. W. Lowe;M. Butkiewicz, M. Spellings, A. Omlor and J. Meiler
Comparative Analysis of Machine Learning Techniques for the Prediction of LogP (2011) IEEE Symposium on Computational Intelligence in Bioinformatics and Computational Biology

Butkiewicz M;Lowe EW, Mueller R, Mendenhall JL, Teixeira PL, Weaver CD, Meiler J.
Benchmarking Ligand-Based Virtual High-Throughput Screening with the PubChem Database (2013) Molecules

Mariusz Butkiewicz;Edward W. Lowe, Jr. and Jens Meiler
Bcl::ChemInfo - Qualitative Analysis Of Machine Learning Models For Activation Of HSD Involved In Alzheimer’s Disease (2012) Computational Intelligence in Bioinformatics and Computational Biology (CIBCB), IEEE Symposium

Edward W. Lowe;Mariusz Butkiewicz, Matthew Spellings, Albert Omlor, and Jens Meiler
Comparative Analysis of Machine Learning Techniques for the Prediction of LogP (2011) Computational Intelligence in Bioinformatics and Computational Biology (CIBCB), IEEE Symposium

Edward W. Lowe;Mariusz Butkiewicz, Zollie White III, Matthew Spellings, Albert Omlor, and Jens Meiler
Comparative Analysis of Machine Learning Techniques for the Prediction of the DMPK Parameters Intrinsic Clearance and Plasma Protein Binding (2012) Proceedings of 4th International Conference on Bioinformatics and Computational Biology

Butkiewicz M;Wang Y, Bryant SH, Lowe EW Jr, Weaver DC, Meiler J
High-Throughput Screening Assay Datasets from the PubChem Database. (2017) Chem Inform.