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Florence L. Stahura
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Journal Articles
- 2005
- [j13]Jeffrey W. Godden, Florence L. Stahura, Jürgen Bajorath:
Anatomy of Fingerprint Search Calculations on Structurally Diverse Sets of Active Compounds. J. Chem. Inf. Model. 45(6): 1812-1819 (2005) - 2004
- [j12]Jeffrey W. Godden, John R. Furr, Ling Xue, Florence L. Stahura, Jürgen Bajorath:
Molecular Similarity Analysis and Virtual Screening by Mapping of Consensus Positions in Binary-Transformed Chemical Descriptor Spaces with Variable Dimensionality. J. Chem. Inf. Model. 44(1): 21-29 (2004) - [j11]Ling Xue, Jeffrey W. Godden, Florence L. Stahura, Jürgen Bajorath:
Similarity Search Profiles as a Diagnostic Tool for the Analysis of Virtual Screening Calculations. J. Chem. Inf. Model. 44(4): 1275-1281 (2004) - [j10]Ling Xue, Florence L. Stahura, Jürgen Bajorath:
Similarity Search Profiling Reveals Effects of Fingerprint Scaling in Virtual Screening. J. Chem. Inf. Model. 44(6): 2032-2039 (2004) - 2003
- [j9]Ling Xue, Jeffrey W. Godden, Florence L. Stahura, Jürgen Bajorath:
Design and Evaluation of a Molecular Fingerprint Involving the Transformation of Property Descriptor Values into a Binary Classification Scheme. J. Chem. Inf. Comput. Sci. 43(4): 1151-1157 (2003) - [j8]Ling Xue, Jeffrey W. Godden, Florence L. Stahura, Jürgen Bajorath:
Profile Scaling Increases the Similarity Search Performance of Molecular Fingerprints Containing Numerical Descriptors and Structural Keys. J. Chem. Inf. Comput. Sci. 43(4): 1218-1225 (2003) - 2002
- [j7]Florence L. Stahura, Jeffrey W. Godden, Jürgen Bajorath:
Differential Shannon Entropy Analysis Identifies Molecular Property Descriptors that Predict Aqueous Solubility of Synthetic Compounds with High Accuracy in Binary QSAR Calculations. J. Chem. Inf. Comput. Sci. 42(3): 550-558 (2002) - [j6]Jeffrey W. Godden, Ling Xue, Douglas B. Kitchen
, Florence L. Stahura, E. James Schermerhorn, Jürgen Bajorath:
Median Partitioning: A Novel Method for the Selection of Representative Subsets from Large Compound Pools. J. Chem. Inf. Comput. Sci. 42(4): 885-893 (2002) - 2001
- [j5]Ling Xue, Florence L. Stahura, Jeffrey W. Godden, Jürgen Bajorath:
Mini-fingerprints Detect Similar Activity of Receptor Ligands Previously Recognized Only by Three-Dimensional Pharmacophore-Based Methods. J. Chem. Inf. Comput. Sci. 41(2): 394-401 (2001) - [j4]Ling Xue, Florence L. Stahura, Jeffrey W. Godden, Jürgen Bajorath:
Fingerprint Scaling Increases the Probability of Identifying Molecules with Similar Activity in Virtual Screening Calculations. J. Chem. Inf. Comput. Sci. 41(3): 746-753 (2001) - 2000
- [j3]Jeffrey W. Godden, Florence L. Stahura, Jürgen Bajorath:
Variability of Molecular Descriptors in Compound Databases Revealed by Shannon Entropy Calculations. J. Chem. Inf. Comput. Sci. 40(3): 796-800 (2000) - [j2]Florence L. Stahura, Jeffrey W. Godden, Ling Xue, Jürgen Bajorath:
Distinguishing between Natural Products and Synthetic Molecules by Descriptor Shannon Entropy Analysis and Binary QSAR Calculations. J. Chem. Inf. Comput. Sci. 40(5): 1245-1252 (2000) - 1999
- [j1]Jeffrey W. Godden, Florence L. Stahura, Jürgen Bajorath:
Statistical analysis of computational docking of large compound data bases to distinct protein binding sites. J. Comput. Chem. 20(15): 1634-1643 (1999)
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