Comparison of Topological, Shape, and Docking Methods in Virtual Screening von McGaughey, Georgia B, Sheridan, Robert P, Bayly, Christopher I, Culberson, J. Chris, Kreatsoulas, Constantine, Lindsley, Stacey, Maiorov, Vladimir, Truchon, Jean-Francois, Cornell, Wendy D

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Prediction Accuracy of Production ADMET Models as a Function of Version: Activity Cliffs Rule von Sheridan, Robert P., Culberson, J. Chris, Joshi, Elizabeth, Tudor, Matthew, Karnachi, Prabha

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Molecular Transformations as a Way of Finding and Exploiting Consistent Local QSAR von Sheridan, Robert P, Hunt, Peter, Culberson, J. Chris

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Absolute configuration assignment of (+)‐fluralaner using vibrational circular dichroism von Kong, John, Joyce, Leo A., Liu, Jinchu, Jarrell, Tiffany M., Culberson, J. Chris, Sherer, Edward C.

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Iterative Focused Screening with Biological Fingerprints Identifies Selective Asc‑1 Inhibitors Distinct from Traditional High Throughput Screening von Kutchukian, Peter S, Warren, Lee, Magliaro, Brian C, Amoss, Adam, Cassaday, Jason A, O’Donnell, Gregory, Squadroni, Brian, Zuck, Paul, Pascarella, Danette, Culberson, J. Chris, Cooke, Andrew J, Hurzy, Danielle, Schlegel, Kelly-Ann Sondra, Thomson, Fiona, Johnson, Eric N, Uebele, Victor N, Hermes, Jeffrey D, Parmentier-Batteur, Sophie, Finley, Michael

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Scoring of KDR kinase inhibitors: using interaction energy as a guide for ranking von McGaughey, Georgia B, Culberson, J Chris, Feuston, Bradley P, Kreatsoulas, Constantine, Maiorov, Vladimir, Shpungin, Joseph

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Synthesis of 1,19-Aza-1,19-desoxy-avermectin B1a:  The First Avermectin Macrolactam von Meinke, Peter T, Arison, Byron, Culberson, J. Chris, Fisher, Michael H, Mrozik, Helmut

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Binding model for nonpeptide antagonists of alpha(v)beta(3) integrin von Feuston, Bradley P, Culberson, J Chris, Duggan, Mark E, Hartman, George D, Leu, Chih-Tai, Rodan, Sevgi B

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Binding Model for Nonpeptide Antagonists of αvβ3 Integrin von Feuston, Bradley P, Culberson, J. Chris, Duggan, Mark E, Hartman, George D, Leu, Chih-Tai, Rodan, Sevgi B

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Structure-Based Design of HIV-1 Protease Inhibitors: Replacement of Two Amides and a 10.pi.-Aromatic System by a Fused Bis-tetrahydrofuran von Ghosh, Arun K, Thompson, Wayne J, Fitzgerald, Paula M. D, Culberson, J. Chris, Axel, Melinda G, McKee, Sean P, Huff, Joel R, Anderson, Paul S

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Binding Model for Nonpeptide Antagonists of α v β 3 Integrin von Feuston, Bradley P., Culberson, J. Chris, Duggan, Mark E., Hartman, George D., Leu, Chih-Tai, Rodan, Sevgi B.

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Structure-based design of HIV-1 protease inhibitors : replacement of two amides and a 10π-aromatic system by a fused bis-tetrahydrofuran von GHOSH, A. K, THOMPSON, W. J, FITZGERALD, P. M. D, CULBERSON, J. C, AXEL, M. G, MCKEE, S. P, HUFF, J. R, ANDERSON, P. S

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Effect of template secondary structure on the inhibition of HIV-1 reverse transcriptase by a pyridinone non-nucleoside inhibitor von Oisen, David B., Carroll, Steven S., Culberson, J.Chris, Shafer, Jules A., Kuo, Lawrence C.

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Human Immunodeficiency Virus Type 1 Protease Inhibitors: Evaluation of Resistance Engendered by Amino Acid Substitutions in the Enzyme's Substrate Binding Site von Sardana, Vinod V, Schlabach, Abner J, Graham, Pia, Bush, Bruce L, Condra, Jon H, Culberson, J. Chris, Gotlib, Leah, Graham, Donald J, Kohl, Nancy E

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Synthesis of 1,19-Aza-1,19-desoxy-avermectin B 1a :  The First Avermectin Macrolactam von Meinke, Peter T., Arison, Byron, Culberson, J. Chris, Fisher, Michael H., Mrozik, Helmut

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1-(((7,7-Dimethyl-2(S)-(2(S)-amino-4-(methylsulfonyl)butyramido)bicyclo[2.2.1]heptan-1(S)-yl)methyl)sulfonyl)-4-(2-methylphenyl)piperazine (L-368,899): An Orally Bioavailable, Non-... von Williams, Peter D, Anderson, Paul S, Ball, Richard G, Bock, Mark G, Carroll, LeighAnne, Chiu, Shuet-Hing Lee, Clineschmidt, Bradley V, Culberson, J. Chris, Erb, Jill M

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[21] Qualitative study of drug resistance in retroviral protease using structural modeling and site-directed mutagenesis von Culberson, J.Chris, Bush, Bruce L., Sardana, Vinod V.

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Conformationally constrained o-tolylpiperazine camphorsulfonamide oxytocin antagonists. Structural modifications that provide high receptor affinity and suggest a bioactive conform... von Williams, Peter D., Ball, Richard G., Clineschmidt, Bradley V., Culberson, J.Chris, Erb, Jill M., Freidinger, Roger M., Pawluczyk, Joseph M., Perlow, Debra S., Pettibone, Douglas J., Veber, Daniel F.

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Carboxylic acid replacement structure-activity relationships in suosan type sweeteners. A sweet taste antagonist. 1 von Muller, George W, Culberson, J. Chris, Roy, Glenn, Ziegler, Jeanette, Walters, D. Eric, Kellogg, Michael S, Schiffman, Susan S, Warwick, Zoe S

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Chapter 2 - Chemical Space and the Difference Between Natural Products and Synthetics von Singh, Sheo B., Culberson, J. Chris

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