Culberson JC - Search Results

1

Comparison of knowledge-based and distance geometry approaches for generation of molecular conformations.

Feuston BP, Miller MD, Culberson JC, Nachbar RB, Kearsley SK. Feuston BP, et al. Among authors: culberson jc. J Chem Inf Comput Sci. 2001 May-Jun;41(3):754-63. doi: 10.1021/ci000464g. J Chem Inf Comput Sci. 2001. PMID: 11410056

2

Molecular model of the alpha(IIb)beta(3) integrin.

Feuston BP, Culberson JC, Hartman GD. Feuston BP, et al. Among authors: culberson jc. J Med Chem. 2003 Dec 4;46(25):5316-25. doi: 10.1021/jm030146j. J Med Chem. 2003. PMID: 14640540

3

Reagent Selector: using Synthon Analysis to visualize reagent properties and assist in combinatorial library design.

Mosley RT, Culberson JC, Kraker B, Feuston BP, Sheridan RP, Conway JF, Forbes JK, Chakravorty SJ, Kearsley SK. Mosley RT, et al. Among authors: culberson jc. J Chem Inf Model. 2005 Sep-Oct;45(5):1439-46. doi: 10.1021/ci050090x. J Chem Inf Model. 2005. PMID: 16180921

4

Random forest: a classification and regression tool for compound classification and QSAR modeling.

Svetnik V, Liaw A, Tong C, Culberson JC, Sheridan RP, Feuston BP. Svetnik V, et al. Among authors: culberson jc. J Chem Inf Comput Sci. 2003 Nov-Dec;43(6):1947-58. doi: 10.1021/ci034160g. J Chem Inf Comput Sci. 2003. PMID: 14632445

5

Binding model for nonpeptide antagonists of alpha(v)beta(3) integrin.

Feuston BP, Culberson JC, Duggan ME, Hartman GD, Leu CT, Rodan SB. Feuston BP, et al. Among authors: culberson jc. J Med Chem. 2002 Dec 19;45(26):5640-8. doi: 10.1021/jm0203130. J Med Chem. 2002. PMID: 12477347

6

Scoring of KDR kinase inhibitors: using interaction energy as a guide for ranking.

McGaughey GB, Culberson JC, Feuston BP, Kreatsoulas C, Maiorov V, Shpungin J. McGaughey GB, et al. Among authors: culberson jc. Mol Divers. 2006 Aug;10(3):341-7. doi: 10.1007/s11030-006-9037-1. Epub 2006 Sep 27. Mol Divers. 2006. PMID: 17004013

7

Web enabling technology for the design, enumeration, optimization and tracking of compound libraries.

Feuston BP, Chakravorty SJ, Conway JF, Culberson JC, Forbes J, Kraker B, Lennon PA, Lindsley C, McGaughey GB, Mosley R, Sheridan RP, Valenciano M, Kearsley SK. Feuston BP, et al. Among authors: culberson jc. Curr Top Med Chem. 2005;5(8):773-83. doi: 10.2174/1568026054637656. Curr Top Med Chem. 2005. PMID: 16101417 Review.

8

Comparison of topological, shape, and docking methods in virtual screening.

McGaughey GB, Sheridan RP, Bayly CI, Culberson JC, Kreatsoulas C, Lindsley S, Maiorov V, Truchon JF, Cornell WD. McGaughey GB, et al. Among authors: culberson jc. J Chem Inf Model. 2007 Jul-Aug;47(4):1504-19. doi: 10.1021/ci700052x. Epub 2007 Jun 26. J Chem Inf Model. 2007. PMID: 17591764

9

Prediction Accuracy of Production ADMET Models as a Function of Version: Activity Cliffs Rule.

Sheridan RP, Culberson JC, Joshi E, Tudor M, Karnachi P. Sheridan RP, et al. Among authors: culberson jc. J Chem Inf Model. 2022 Jul 25;62(14):3275-3280. doi: 10.1021/acs.jcim.2c00699. Epub 2022 Jul 7. J Chem Inf Model. 2022. PMID: 35796226 Review.

10

Molecular transformations as a way of finding and exploiting consistent local QSAR.

Sheridan RP, Hunt P, Culberson JC. Sheridan RP, et al. Among authors: culberson jc. J Chem Inf Model. 2006 Jan-Feb;46(1):180-92. doi: 10.1021/ci0503208. J Chem Inf Model. 2006. PMID: 16426054

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