Curt M. Breneman : rechercher sur Z-Library

Le plus grand référentiel d'articles scientifiques au monde. 70,000,000+ d'articles gratuitement.

Don't use scam websites

Livres
Articles (59)
Les plus populaires
Liste
- Liste
- Tableau

1

Fast Bundle Algorithm for Multiple-Instance Learning

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

Journal:

IEEE Transactions on Pattern Analysis and Machine Intelligence

Année:

2012

Langue:

english

Fichier:

PDF, 1.55 MB

english, 2012

2

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

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

Journal:

Journal of Chemical Information and Modeling

Année:

2013

Langue:

english

Fichier:

PDF, 4.43 MB

english, 2013

3

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

Breneman, Curt M., Rhem, Marlon

Journal:

Journal of Computational Chemistry

Année:

1997

Langue:

english

Fichier:

PDF, 333 KB

english, 1997

4

Regioselectivity of the Photochemical Addition of Ammonia, Phosphine, and Silane to Olefinic and Acetylenic Nitriles

Jean-Claude Guillemin, Curt M. Breneman, Jeffrey C. Joseph, James P. Ferris

Journal:

Chemistry - A European Journal

Année:

1998

Langue:

english

Fichier:

PDF, 176 KB

english, 1998

5

High-throughput screening and quantitative structure-efficacy relationship models of potential displacer molecules for ion-exchange systems

Cecilia B. Mazza, Kaushal Rege, Curt M. Breneman, N. Sukumar, Jonathan S. Dordick, Steven M. Cramer

Journal:

Biotechnology and Bioengineering

Année:

2002

Langue:

english

Fichier:

PDF, 337 KB

english, 2002

6

Investigation of protein retention and selectivity in HIC systems using quantitative structure retention relationship models

Asif Ladiwala, Fang Xia, Qiong Luo, Curt M. Breneman, Steven M. Cramer

Journal:

Biotechnology and Bioengineering

Année:

2006

Langue:

english

Fichier:

PDF, 313 KB

english, 2006

7

ChemInform Abstract: The Electron Density Distribution of Amides and Related Compounds

Curt M. Breneman, Martin Martinov

Journal:

Année:

2000

Fichier:

PDF, 24 KB

2000

8

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

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

Journal:

Année:

2003

Fichier:

PDF, 52 KB

2003

9

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 Breneman, William Katt

Journal:

Année:

2004

Fichier:

PDF, 54 KB

2004

10

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

Wei Deng, Curt Breneman, Mark J. Embrechts

Journal:

Année:

2004

Fichier:

PDF, 52 KB

2004

11

Determining atom-centered monopoles from molecular electrostatic potentials. The need for high sampling density in formamide conformational analysis

Curt M. Breneman, Kenneth B. Wiberg

Journal:

Journal of Computational Chemistry

Année:

1990

Langue:

english

Fichier:

PDF, 971 KB

english, 1990

12

Modeling Choices for Virtual Screening Hit Identification

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

Journal:

Molecular Informatics

Année:

2011

Langue:

english

Fichier:

PDF, 2.04 MB

english, 2011

13

Electron density modeling of large systems using the transferable atom equivalent method

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

Journal:

Computers & Chemistry

Année:

1995

Langue:

english

Fichier:

PDF, 1.37 MB

english, 1995

14

Three-dimensional quantitative structure–activity relationship analyses of piperidine-based CCR5 receptor antagonists

Minghu Song, Curt M. Breneman, N. Sukumar

Journal:

Bioorganic & Medicinal Chemistry

Année:

2004

Langue:

english

Fichier:

PDF, 526 KB

english, 2004

15

Classification of protein adsorption and recovery at low salt conditions in hydrophobic interaction chromatographic systems

Jie Chen, Qiong Luo, Curt M. Breneman, Steven M. Cramer

Journal:

Journal of Chromatography A

Année:

2007

Langue:

english

Fichier:

PDF, 1.36 MB

english, 2007

16

Investigation of multi-modal high-salt binding ion-exchange chromatography using quantitative structure–property relationship modeling

Ting Yang, Curt M. Breneman, Steven M. Cramer

Journal:

Journal of Chromatography A

Année:

2007

Langue:

english

Fichier:

PDF, 829 KB

english, 2007

17

Investigation of protein retention in hydrophobic interaction chromatographic (HIC) systems using the preferential interaction theory and quantitative structure property relationship models

Jie Chen, Ting Yang, Qiong Luo, Curt M. Breneman, Steven M. Cramer

Journal:

Reactive and Functional Polymers

Année:

2007

Langue:

english

Fichier:

PDF, 390 KB

english, 2007

18

Further insight into lower order cuprate chemistry; On the use of CuBr·Me2S vs CuI en route to R2CuLi

Bruce H. Lipshutz, Scott Whitney, Joseph A Kozlowski, Curt M Breneman

Journal:

Tetrahedron Letters

Année:

1986

Langue:

english

Fichier:

PDF, 228 KB

english, 1986

19

Ligand mixing in lower order organocuprates: synthetic, mechanistic, and structural implications

Bruce H. Lipshutz, Joseph A. Kozlowski, Curt M. Breneman

Journal:

Tetrahedron Letters

Année:

1985

Langue:

english

Fichier:

PDF, 218 KB

english, 1985

20

A mass spectrometry study of tirapazamine and its metabolites: insights into the mechanism of metabolic transformations and the characterization of reaction intermediates

Dmitri Zagorevskii, Minghu Song, Curt Breneman, Yang Yuan, Tarra Fuchs, Kent S Gates, C.Michael Greenlief

Journal:

Journal of the American Society for Mass Spectrometry

Année:

2003

Langue:

english

Fichier:

PDF, 242 KB

english, 2003

21

Internal rotation in enaminonitriles: Investigation by dynamic NMR spectroscopy and molecular modeling

J. A. Moore, Parag G. Mehta, Curt M. Breneman

Journal:

Structural Chemistry

Année:

1997

Langue:

english

Fichier:

PDF, 888 KB

english, 1997

22

The rotational barrier of an enaminonitrile. Charge and energy redistribution during rotation about the C-N bond

Curt M. Breneman, J. A. Moore

Journal:

Structural Chemistry

Année:

1997

Langue:

english

Fichier:

PDF, 428 KB

english, 1997

23

Parallel screening of selective and high-affinity displacers for proteins in ion-exchange systems

Kaushal Rege, Asif Ladiwala, Nihal Tugcu, Curt M. Breneman, Steven M. Cramer

Journal:

Journal of Chromatography A

Année:

2004

Langue:

english

Fichier:

PDF, 223 KB

english, 2004

24

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

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

Journal:

Journal of Chemical Information and Modeling

Année:

2012

Langue:

english

Fichier:

PDF, 984 KB

english, 2012

25

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

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

Journal:

Journal of Chemical Information and Modeling

Année:

2011

Langue:

english

Fichier:

PDF, 3.62 MB

english, 2011

26

MQSPR modeling in materials informatics: a way to shorten design cycles?

Sukumar, N., Krein, Michael, Luo, Qiong, Breneman, Curt

Journal:

Journal of Materials Science

Année:

2012

Langue:

english

Fichier:

PDF, 967 KB

english, 2012

27

SMARTCyp: A 2D Method for Prediction of Cytochrome P450-Mediated Drug Metabolism

Rydberg, Patrik, Gloriam, David E., Zaretzki, Jed, Breneman, Curt, Olsen, Lars

Journal:

ACS Medicinal Chemistry Letters

Année:

2010

Langue:

english

Fichier:

PDF, 1.35 MB

english, 2010

28

Rank Order Entropy: Why One Metric Is Not Enough

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

Journal:

Journal of Chemical Information and Modeling

Année:

2011

Langue:

english

Fichier:

PDF, 4.53 MB

english, 2011

29

Chemical and spectroscopic studies on copper iodide derived organocuprates: new insight into the composition of Gilman's reagent

Lipshutz, Bruce H., Kozlowski, Joseph A., Breneman, Curt M.

Journal:

Journal of the American Chemical Society

Année:

1985

Langue:

english

Fichier:

PDF, 851 KB

english, 1985

30

Analysis of the effect of electron correlation on charge density distributions

Wiberg, Kenneth B., Hadad, Christopher M., LePage, Teresa J., Breneman, Curt M., Frisch, Michael J.

Journal:

Journal of Physical Chemistry

Année:

1992

Langue:

english

Fichier:

PDF, 1.05 MB

english, 1992

31

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

Das, Sourav, Kokardekar, Arshad, Breneman, Curt M.

Journal:

Journal of Chemical Information and Modeling

Année:

2009

Langue:

english

Fichier:

PDF, 2.92 MB

english, 2009

32

Evaluation of Chemically Selective Displacer Analogues for Protein Purification

Morrison, Christopher J., Breneman, Curt M., Moore, J. A., Cramer, Steven M.

Journal:

Analytical Chemistry

Année:

2009

Langue:

english

Fichier:

PDF, 3.71 MB

english, 2009

33

Investigation of Mobile Phase Salt Type Effects on Protein Retention and Selectivity in Cation-Exchange Systems Using Quantitative Structure Retention Relationship Models

Ladiwala, Asif, Rege, Kaushal, Breneman, Curt M., Cramer, Steven M.

Journal:

Année:

2003

Langue:

english

Fichier:

PDF, 275 KB

english, 2003

34

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

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

Journal:

Journal of Chemical Information and Modeling

Année:

2011

Langue:

english

Fichier:

PDF, 1.68 MB

english, 2011

35

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

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

Journal:

Journal of Chemical Information and Modeling

Année:

2005

Langue:

english

Fichier:

PDF, 210 KB

english, 2005

36

Discovery of antibiotics-derived polymers for gene delivery using combinatorial synthesis and cheminformatics modeling

Potta, Thrimoorthy, Zhen, Zhuo, Grandhi, Taraka Sai Pavan, Christensen, Matthew D., Ramos, James, Breneman, Curt M., Rege, Kaushal

Journal:

Année:

2014

Langue:

english

Fichier:

PDF, 2.12 MB

english, 2014

37

Binding Affinity Prediction with Property-Encoded Shape Distribution Signatures

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

Journal:

Journal of Chemical Information and Modeling

Année:

2010

Langue:

english

Fichier:

PDF, 2.98 MB

english, 2010

38

Identification of Chemically Selective Displacers Using Parallel Batch Screening Experiments and Quantitative Structure Efficacy Relationship Models

Tugcu, Nihal, Ladiwala, Asif, Breneman, Curt M., Cramer, Steven M.

Journal:

Analytical Chemistry

Année:

2003

Langue:

english

Fichier:

PDF, 241 KB

english, 2003

39

Use of Cationic Aerosol Photopolymerization To Form Silicone Microbeads in the Presence of Molecular Templates

Vorderbruggen, Mark A., Wu, Kenneth, Breneman, Curt M.

Journal:

Chemistry of Materials

Année:

1999

Fichier:

PDF, 6 KB

1999

40

Use of Cationic Aerosol Photopolymerization To Form Silicone Microbeads in the Presence of Molecular Templates

Vorderbruggen, Mark A., Wu, Kenneth, Breneman, Curt M.

Journal:

Chemistry of Materials

Année:

1996

Langue:

english

Fichier:

PDF, 171 KB

english, 1996

41

Prediction of the Effect of Mobile-Phase Salt Type on Protein Retention and Selectivity in Anion Exchange Systems

Tugcu, Nihal, Song, Minghu, Breneman, Curt M., Sukumar, N., Bennett, Kristin P., Cramer, Steven M.

Journal:

Analytical Chemistry

Année:

2003

Langue:

english

Fichier:

PDF, 197 KB

english, 2003

42

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

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

Journal:

Journal of Chemical Information and Modeling

Année:

2006

Langue:

english

Fichier:

PDF, 262 KB

english, 2006

43

Substituent effects. 1. Methyl derivatives

Wiberg, Kenneth B., Breneman, Curt M.

Journal:

Journal of the American Chemical Society

Année:

1990

Langue:

english

Fichier:

PDF, 1.26 MB

english, 1990

44

Resonance interactions in acyclic systems. 3. Formamide internal rotation revisited. Charge and energy redistribution along the C-N bond rotational pathway

Wiberg, Kenneth B., Breneman, Curt M.

Journal:

Journal of the American Chemical Society

Année:

1992

Langue:

english

Fichier:

PDF, 1.61 MB

english, 1992

45

Stalking the Materials Genome: A Data-Driven Approach to the Virtual Design of Nanostructured Polymers

Breneman, Curt M., Brinson, L. Catherine, Schadler, Linda S., Natarajan, Bharath, Krein, Michael, Wu, Ke, Morkowchuk, Lisa, Li, Yang, Deng, Hua, Xu, Hongyi

Journal:

Advanced Functional Materials

Année:

2013

Langue:

english

Fichier:

PDF, 1.38 MB

english, 2013

46

Charge and energy redistribution in sulfonamides undergoing conformational changes. Hybridization as a controlling influence over conformer stability

Breneman, Curt M., Weber, Lawrence W.

Journal:

Canadian Journal of Chemistry

Année:

1996

Langue:

english

Fichier:

PDF, 690 KB

english, 1996

47

[IEEE 2014 IEEE Conference on Electrical Insulation and Dielectric Phenomena - (CEIDP 2014) - Des Moines, IA, USA (2014.10.19-2014.10.22)] 2014 IEEE Conference on Electrical Insulation and Dielectric Phenomena (CEIDP) - Prediction of interface dielectric relaxations in bimodal brush functionalized epoxy nanodielectrics by finite element analysis method

Huang, Yanhui, Krentz, Timothy M., Nelson, J. Keith, Schadler, Linda S., Li, Yang, Zhao, He, Brinson, L. Catherine, Bell, Michael, Benicewicz, Brian, Wu, Ke, Breneman, Curt M.

Année:

2014

Langue:

english

Fichier:

PDF, 888 KB

english, 2014

48

Development of Materials Informatics Tools and Infrastructure to Enable High Throughput Materials Design

Krein, Michael P., Natarajan, Bharath, Schadler, Linda S., Brinson, L. C., Deng, Hua, Gai, Donghai, Li, Yang, Breneman, Curt M.

Journal:

MRS Proceedings

Année:

2012

Langue:

english

Fichier:

PDF, 447 KB

english, 2012

49

Parallel Synthesis and Quantitative Structure–Activity Relationship (QSAR) Modeling of Aminoglycoside-Derived Lipopolymers for Transgene Expression

Miryala, Bhavani, Zhen, Zhuo, Potta, Thrimoorthy, Breneman, Curt M., Rege, Kaushal

Journal:

ACS Biomaterials Science & Engineering

Année:

2015

Langue:

english

Fichier:

PDF, 2.52 MB

english, 2015

50

[ACM Press the 25th international conference - Helsinki, Finland (2008.07.05-2008.07.09)] Proceedings of the 25th international conference on Machine learning - ICML '08 - Multiple instance ranking

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

Année:

2008

Langue:

english

Fichier:

PDF, 379 KB

english, 2008