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Robert C. Glen

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2006
23 Michael R. Berthold, Robert C. Glen, Ingrid Fischer: Computational Life Sciences II, Second International Symposium, CompLife 2006, Cambridge, UK, September 27-29, 2006, Proceedings Springer 2006
22EEDmitry Nerukh, George Karvounis, Robert C. Glen: Dynamic Complexity of Chaotic Transitions in High-Dimensional Classical Dynamics: Leu-Enkephalin Folding. CompLife 2006: 129-140
21EEHamse Y. Mussa, David J. Lary, Robert C. Glen: Building Structure-Property Predictive Models Using Data Assimilation. CompLife 2006: 64-73
20EESarah Rodgers, Robert C. Glen, Andreas Bender: Characterizing Bitterness: Identification of Key Structural Features and Development of a Classification Model. Journal of Chemical Information and Modeling 46(2): 569-576 (2006)
19EEAlireza Givehchi, Andreas Bender, Robert C. Glen: Analysis of Activity Space by Fragment Fingerprints, 2D Descriptors, and Multitarget Dependent Transformation of 2D Descriptors. Journal of Chemical Information and Modeling 46(3): 1078-1083 (2006)
2005
18 Michael R. Berthold, Robert C. Glen, Kay Diederichs, Oliver Kohlbacher, Ingrid Fischer: Computational Life Sciences, First International Symposium, CompLife 2005, Konstanz, Germany, September 25-27, 2005, Proceedings Springer 2005
17EEAndreas Bender, Andreas Klamt, Karin Wichmann, Michael Thormann, Robert C. Glen: Molecular Similarity Searching Using COSMO Screening Charges (COSMO/3PP). CompLife 2005: 175-185
16EEMuthukumarasamy Karthikeyan, Robert C. Glen, Andreas Bender: General Melting Point Prediction Based on a Diverse Compound Data Set and Artificial Neural Networks. Journal of Chemical Information and Modeling 45(3): 581-590 (2005)
15EEAndreas Bender, Robert C. Glen: A Discussion of Measures of Enrichment in Virtual Screening: Comparing the Information Content of Descriptors with Increasing Levels of Sophistication. Journal of Chemical Information and Modeling 45(5): 1369-1375 (2005)
2004
14EEAndreas Bender, Hamse Y. Mussa, Gurprem S. Gill, Robert C. Glen: Molecular surface point environments for virtual screening and the elucidation of binding patterns (MOLPRINT). SMC (5) 2004: 4553-4558
13EEDmitry Nerukh, George Karvounis, Robert C. Glen: Quantifying the complexity of chaos in multibasin multidimensional dynamics of molecular systems. Complexity 10(2): 40-46 (2004)
12EEAndreas Bender, Hamse Y. Mussa, Robert C. Glen, Stephan Reiling: Molecular Similarity Searching Using Atom Environments, Information-Based Feature Selection, and a Naïve Bayesian Classifier. Journal of Chemical Information and Modeling 44(1): 170-178 (2004)
11EEAndreas Bender, Hamse Y. Mussa, Robert C. Glen, Stephan Reiling: Similarity Searching of Chemical Databases Using Atom Environment Descriptors (MOLPRINT 2D): Evaluation of Performance. Journal of Chemical Information and Modeling 44(5): 1708-1718 (2004)
2003
10EELi Xing, Robert C. Glen, Robert D. Clark: Predicting pKa by Molecular Tree Structured Fingerprints and PLS. Journal of Chemical Information and Computer Sciences 43(3): 870-879 (2003)
2002
9EELi Xing, Robert C. Glen: Novel Methods for the Prediction of logP, pKa, and logD. Journal of Chemical Information and Computer Sciences 42(4): 796-805 (2002)
1997
8EEBernd Beck, Timothy Clark, Robert C. Glen: VESPA: A new, fast approach to electrostatic potential-derived atomic charges from semiempirical methods. Journal of Computational Chemistry 18(6): 744-756 (1997)
1995
7 Robert C. Glen, A. W. R. Payne: A genetic algorithm for the automated generation of molecules within constraints. Journal of Computer-Aided Molecular Design 9(2): 181-202 (1995)
6 Gareth Jones, Peter Willett, Robert C. Glen: A genetic algorithm for flexible molecular overlay and pharmacophore elucidation. Journal of Computer-Aided Molecular Design 9(6): 532-549 (1995)
1994
5EEDavid E. Clark, Gareth Jones, Peter Willett, Peter W. Kenny, Robert C. Glen: Pharmacophoric pattern matching in files of three-dimensional chemical structures: Comparison of conformational-searching algorithms for flexible searching. Journal of Chemical Information and Computer Sciences 34(1): 197-206 (1994)
4EERobert D. Brown, Gareth Jones, Peter Willett, Robert C. Glen: Matching two-dimensional chemical graphs using genetic algorithms. Journal of Chemical Information and Computer Sciences 34(1): 63-70 (1994)
3 Robert C. Glen: A fast empirical method for the calculation of molecular polarizability. Journal of Computer-Aided Molecular Design 8(4): 457-466 (1994)
1993
2 Gareth Jones, Robert D. Brown, David E. Clark, Peter Willett, Robert C. Glen: Searching Databases of Two-Dimensional and Three-Dimensional Chemical Structures Using Genetic Algorithms. ICGA 1993: 597-602
1992
1 Mohammed A-Razzak, Robert C. Glen: Applications of rule-induction in the derivation of quantitative structure-activity relationships. Journal of Computer-Aided Molecular Design 6(4): 349-383 (1992)

Coauthor Index

1Mohammed A-Razzak [1]
2Bernd Beck [8]
3Andreas Bender [11] [12] [14] [15] [16] [17] [19] [20]
4Michael R. Berthold [18] [23]
5Robert D. Brown [2] [4]
6David E. Clark [2] [5]
7Robert D. Clark [10]
8Timothy Clark [8]
9Kay Diederichs [18]
10Ingrid Fischer [18] [23]
11Gurprem S. Gill [14]
12Alireza Givehchi [19]
13Gareth Jones [2] [4] [5] [6]
14Muthukumarasamy Karthikeyan [16]
15George Karvounis [13] [22]
16Peter W. Kenny [5]
17Andreas Klamt [17]
18Oliver Kohlbacher [18]
19David J. Lary [21]
20Hamse Y. Mussa [11] [12] [14] [21]
21Dmitry Nerukh [13] [22]
22A. W. R. Payne [7]
23Stephan Reiling [11] [12]
24Sarah Rodgers [20]
25Michael Thormann [17]
26Karin Wichmann [17]
27Peter Willett [2] [4] [5] [6]
28Li Xing [9] [10]

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Copyright © Sun May 17 03:24:02 2009 by Michael Ley (ley@uni-trier.de)