Curt M. Breneman

According to our database, Curt M. Breneman authored at least 26 papers between 1995 and 2018.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2018

Cadre Modeling: Simultaneously Discovering Subpopulations and Predictive Models.

Alexander New, Curt M. Breneman, Kristin P. Bennett

Proceedings of the 2018 International Joint Conference on Neural Networks, 2018

2013

New Group IV Chemical Motifs for Improved Dielectric Permittivity of Polyethylene.

G. Pilania, C. C. Wang, K. Wu, Nagamani Sukumar, Curt M. Breneman, G. Sotzing, Rampi Ramprasad

J. Chem. Inf. Model., 2013

DR-Predictor: Incorporating Flexible Docking with Specialized Electronic Reactivity and Machine Learning Techniques to Predict CYP-Mediated Sites of Metabolism.

Tao-wei Huang, Jed Zaretzki, Charles Bergeron, Kristin P. Bennett, Curt M. Breneman

J. Chem. Inf. Model., 2013

RS-WebPredictor: a server for predicting CYP-mediated sites of metabolism on drug-like molecules.

Jed Zaretzki, Charles Bergeron, Tao-wei Huang, Patrik Rydberg, S. Joshua Swamidass, Curt M. Breneman

Bioinform., 2013

2012

Fast Bundle Algorithm for Multiple-Instance Learning.

Charles Bergeron, Gregory M. Moore, Jed Zaretzki, Curt M. Breneman, Kristin P. Bennett

IEEE Trans. Pattern Anal. Mach. Intell., 2012

RS-Predictor Models Augmented with SMARTCyp Reactivities: Robust Metabolic Regioselectivity Predictions for Nine CYP Isozymes.

Jed Zaretzki, Patrik Rydberg, Charles Bergeron, Kristin P. Bennett, Lars Olsen, Curt M. Breneman

J. Chem. Inf. Model., 2012

2011

RS-Predictor: A New Tool for Predicting Sites of Cytochrome P450-Mediated Metabolism Applied to CYP 3A4.

Jed Zaretzki, Charles Bergeron, Patrik Rydberg, Tao-wei Huang, Kristin P. Bennett, Curt M. Breneman

J. Chem. Inf. Model., 2011

Rank Order Entropy: Why One Metric Is Not Enough.

Margaret R. McLellan, M. Dominic Ryan, Curt M. Breneman

J. Chem. Inf. Model., 2011

Exploiting Domain Knowledge for Improved Quantitative High-Throughput Screening Curve Fitting.

Charles Bergeron, Gregory M. Moore, Michael P. Krein, Curt M. Breneman, Kristin P. Bennett

J. Chem. Inf. Model., 2011

Prediction of peptide bonding affinity: kernel methods for nonlinear modeling

Charles Bergeron, Theresa Hepburn, C. Matthew Sundling, Michael P. Krein, William P. Katt, Nagamani Sukumar, Curt M. Breneman, Kristin P. Bennett

CoRR, 2011

2010

Binding Affinity Prediction with Property-Encoded Shape Distribution Signatures.

Sourav Das, Michael P. Krein, Curt M. Breneman

J. Chem. Inf. Model., 2010

PESDserv: a server for high-throughput comparison of protein binding site surfaces.

Sourav Das, Michael P. Krein, Curt M. Breneman

Bioinform., 2010

2009

Rapid Comparison of Protein Binding Site Surfaces with Property Encoded Shape Distributions.

Sourav Das, Arshad Kokardekar, Curt M. Breneman

J. Chem. Inf. Model., 2009

2008

Multiple instance ranking.

Charles Bergeron, Jed Zaretzki, Curt M. Breneman, Kristin P. Bennett

Proceedings of the Machine Learning, 2008

2007

Data Fusion and Auto-fusion for Quantitative Structure-Activity Relationship (QSAR).

Changjian Huang, Mark J. Embrechts, Nagamani Sukumar, Curt M. Breneman

Proceedings of the Artificial Neural Networks, 2007

2006

Chemometric Analysis of Ligand Receptor Complementarity: Identifying Complementary Ligands Based on Receptor Information (CoLiBRI).

Scott Oloff, Shuxing Zhang, Nagamani Sukumar, Curt M. Breneman, Alexander Tropsha

J. Chem. Inf. Model., 2006

2005

Investigation of DNA-Binding Properties of an Aminoglycoside-Polyamine Library Using Quantitative Structure-Activity Relationship (QSAR) Models.

Kaushal Rege, Asif Ladiwala, Shanghui Hu, Curt M. Breneman, Jonathan S. Dordick, Steven M. Cramer

J. Chem. Inf. Model., 2005

2004

Predicting Protein-Ligand Binding Affinities Using Novel Geometrical Descriptors and Machine-Learning Methods.

Wei Deng, Curt M. Breneman, Mark J. Embrechts

J. Chem. Inf. Model., 2004

2003

Dimensionality Reduction via Sparse Support Vector Machines.

Jinbo Bi, Kristin P. Bennett, Mark J. Embrechts, Curt M. Breneman, Minghu Song

J. Mach. Learn. Res., 2003

Electronic van der Waals Surface Property Descriptors and Genetic Algorithms for Developing Structure-Activity Correlations in Olfactory Databases.

Barry K. Lavine, Charles E. Davidson, Curt M. Breneman, William P. Katt

J. Chem. Inf. Comput. Sci., 2003

Transferable atom equivalent multicentered multipole expansion method.

Christopher E. Whitehead, Curt M. Breneman, Nagamani Sukumar, M. Dominic Ryan

J. Comput. Chem., 2003

New developments in PEST shape/property hybrid descriptors.

Curt M. Breneman, C. Matthew Sundling, Nagamani Sukumar, Lingling Shen, William P. Katt, Mark J. Embrechts

J. Comput. Aided Mol. Des., 2003

2002

Prediction of Protein Retention Times in Anion-Exchange Chromatography Systems Using Support Vector Regression.

Minghu Song, Curt M. Breneman, Jinbo Bi, Nagamani Sukumar, Kristin P. Bennett, Steven M. Cramer, Nihal Tugcu

J. Chem. Inf. Comput. Sci., 2002

2000

Data strip mining for the virtual design of pharmaceuticals with neural networks.

Robert H. Kewley, Mark J. Embrechts, Curt M. Breneman

IEEE Trans. Neural Networks Learn. Syst., 2000

1997

QSPR analysis of HPLC column capacity factors for a set of high-energy materials using electronic van der waals surface property descriptors computed by transferable atom equivalent method.

Curt M. Breneman, Marlon Rhem

J. Comput. Chem., 1997

1995

Electron Density Modeling of Large Systems Using the Transferable Atom Equivalent Method.

Curt M. Breneman, Tracy R. Thompson, Marlon Rhem, Mei Dung

Comput. Chem., 1995