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ORCIDCurt M. Breneman
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2010 – 2019
- 2018
[c3]Alexander New
, Curt M. Breneman, Kristin P. Bennett:
Cadre Modeling: Simultaneously Discovering Subpopulations and Predictive Models. IJCNN 2018: 1-8- [i2]Alexander New, Curt M. Breneman, Kristin P. Bennett:
Cadre Modeling: Simultaneously Discovering Subpopulations and Predictive Models. CoRR abs/1802.02500 (2018) - 2013
- [j22]Jed Zaretzki, Charles Bergeron, Tao-wei Huang, Patrik Rydberg, S. Joshua Swamidass, Curt M. Breneman:
RS-WebPredictor: a server for predicting CYP-mediated sites of metabolism on drug-like molecules. Bioinform. 29(4): 497-498 (2013) - [j21]G. Pilania, C. C. Wang, K. Wu, Nagamani Sukumar, Curt M. Breneman, G. Sotzing, Rampi Ramprasad:
New Group IV Chemical Motifs for Improved Dielectric Permittivity of Polyethylene. J. Chem. Inf. Model. 53(4): 879-886 (2013) - [j20]Tao-wei Huang, Jed Zaretzki, Charles Bergeron, Kristin P. Bennett, Curt M. Breneman:
DR-Predictor: Incorporating Flexible Docking with Specialized Electronic Reactivity and Machine Learning Techniques to Predict CYP-Mediated Sites of Metabolism. J. Chem. Inf. Model. 53(12): 3352-3366 (2013) - 2012
- [j19]Jed Zaretzki, Patrik Rydberg, Charles Bergeron, Kristin P. Bennett, Lars Olsen, Curt M. Breneman:
RS-Predictor Models Augmented with SMARTCyp Reactivities: Robust Metabolic Regioselectivity Predictions for Nine CYP Isozymes. J. Chem. Inf. Model. 52(6): 1637-1659 (2012) - [j18]Charles Bergeron, Gregory M. Moore, Jed Zaretzki, Curt M. Breneman, Kristin P. Bennett:
Fast Bundle Algorithm for Multiple-Instance Learning. IEEE Trans. Pattern Anal. Mach. Intell. 34(6): 1068-1079 (2012) - 2011
- [j17]Jed Zaretzki, Charles Bergeron, Patrik Rydberg, Tao-wei Huang, Kristin P. Bennett, Curt M. Breneman:
RS-Predictor: A New Tool for Predicting Sites of Cytochrome P450-Mediated Metabolism Applied to CYP 3A4. J. Chem. Inf. Model. 51(7): 1667-1689 (2011) - [j16]Margaret R. McLellan, M. Dominic Ryan, Curt M. Breneman:
Rank Order Entropy: Why One Metric Is Not Enough. J. Chem. Inf. Model. 51(9): 2302-2319 (2011) - [j15]Charles Bergeron, Gregory M. Moore, Michael P. Krein, Curt M. Breneman, Kristin P. Bennett:
Exploiting Domain Knowledge for Improved Quantitative High-Throughput Screening Curve Fitting. J. Chem. Inf. Model. 51(11): 2808-2820 (2011) - [i1]Charles Bergeron, Theresa Hepburn, C. Matthew Sundling, Michael P. Krein, William P. Katt, Nagamani Sukumar, Curt M. Breneman, Kristin P. Bennett:
Prediction of peptide bonding affinity: kernel methods for nonlinear modeling. CoRR abs/1108.5397 (2011) - 2010
- [j14]Sourav Das, Michael P. Krein, Curt M. Breneman:
PESDserv: a server for high-throughput comparison of protein binding site surfaces. Bioinform. 26(15): 1913-1914 (2010) - [j13]Sourav Das, Michael P. Krein, Curt M. Breneman:
Binding Affinity Prediction with Property-Encoded Shape Distribution Signatures. J. Chem. Inf. Model. 50(2): 298-308 (2010)
2000 – 2009
- 2009
- [j12]Sourav Das, Arshad Kokardekar, Curt M. Breneman:
Rapid Comparison of Protein Binding Site Surfaces with Property Encoded Shape Distributions. J. Chem. Inf. Model. 49(12): 2863-2872 (2009) - 2008
- [c2]Charles Bergeron, Jed Zaretzki, Curt M. Breneman, Kristin P. Bennett:
Multiple instance ranking. ICML 2008: 48-55 - 2007
- [c1]Changjian Huang, Mark J. Embrechts, Nagamani Sukumar, Curt M. Breneman:
Data Fusion and Auto-fusion for Quantitative Structure-Activity Relationship (QSAR). ICANN (1) 2007: 628-637 - 2006
- [j11]Scott Oloff, Shuxing Zhang, Nagamani Sukumar, Curt M. Breneman, Alexander Tropsha:
Chemometric Analysis of Ligand Receptor Complementarity: Identifying Complementary Ligands Based on Receptor Information (CoLiBRI). J. Chem. Inf. Model. 46(2): 844-851 (2006) - 2005
- [j10]Kaushal Rege, Asif Ladiwala, Shanghui Hu, Curt M. Breneman, Jonathan S. Dordick, Steven M. Cramer:
Investigation of DNA-Binding Properties of an Aminoglycoside-Polyamine Library Using Quantitative Structure-Activity Relationship (QSAR) Models. J. Chem. Inf. Model. 45(6): 1854-1863 (2005) - 2004
- [j9]Wei Deng, Curt M. Breneman, Mark J. Embrechts:
Predicting Protein-Ligand Binding Affinities Using Novel Geometrical Descriptors and Machine-Learning Methods. J. Chem. Inf. Model. 44(2): 699-703 (2004) - 2003
- [j8]Curt M. Breneman, C. Matthew Sundling, Nagamani Sukumar, Lingling Shen, William P. Katt, Mark J. Embrechts:
New developments in PEST shape/property hybrid descriptors. J. Comput. Aided Mol. Des. 17(2-4): 231-240 (2003) - [j7]Christopher E. Whitehead, Curt M. Breneman, Nagamani Sukumar, M. Dominic Ryan:
Transferable atom equivalent multicentered multipole expansion method. J. Comput. Chem. 24(4): 512-529 (2003) - [j6]Barry K. Lavine, Charles E. Davidson, Curt M. Breneman, William P. Katt:
Electronic van der Waals Surface Property Descriptors and Genetic Algorithms for Developing Structure-Activity Correlations in Olfactory Databases. J. Chem. Inf. Comput. Sci. 43(6): 1890-1905 (2003) - [j5]Jinbo Bi, Kristin P. Bennett, Mark J. Embrechts, Curt M. Breneman, Minghu Song:
Dimensionality Reduction via Sparse Support Vector Machines. J. Mach. Learn. Res. 3: 1229-1243 (2003) - 2002
- [j4]Minghu Song, Curt M. Breneman, Jinbo Bi, Nagamani Sukumar, Kristin P. Bennett, Steven M. Cramer, Nihal Tugcu:
Prediction of Protein Retention Times in Anion-Exchange Chromatography Systems Using Support Vector Regression. J. Chem. Inf. Comput. Sci. 42(6): 1347-1357 (2002) - 2000
- [j3]Robert H. Kewley, Mark J. Embrechts, Curt M. Breneman:
Data strip mining for the virtual design of pharmaceuticals with neural networks. IEEE Trans. Neural Networks Learn. Syst. 11(3): 668-679 (2000)
1990 – 1999
- 1997
- [j2]Curt M. Breneman, Marlon Rhem:
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. J. Comput. Chem. 18(2): 182-197 (1997) - 1995
- [j1]Curt M. Breneman, Tracy R. Thompson, Marlon Rhem, Mei Dung:
Electron Density Modeling of Large Systems Using the Transferable Atom Equivalent Method. Comput. Chem. 19(3): 161-179 (1995)
Coauthor Index
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