Understanding covariate shift in model performance

Por McGaughey, Georgia, Walters, W. Patrick, Goldman, Brian
Publicado no F1000Res (2016)

Shaping suvorexant: application of experimental and theoretical methods for driving synthetic designs

Por McGaughey, Georgia, Bayly, Christopher I., Cox, Christopher D., Schreier, John D., Breslin, Michael J., Bogusky, Michael, Pitzenberger, Steve, Ball, Richard, Coleman, Paul J.
Publicado em 2014

Molecular Shape and Medicinal Chemistry: A Perspective

Por Nicholls, Anthony, McGaughey, Georgia B., Sheridan, Robert P., Good, Andrew C., Warren, Gregory, Mathieu, Magali, Muchmore, Steven W., Brown, Scott P., Grant, J. Andrew, Haigh, James A., Nevins, Neysa, Jain, Ajay N., Kelley, Brian
Publicado em 2010

Small Molecule Mimetics of an HIV-1 gp41 Fusion Intermediate as Vaccine Leads

Por Caulfield, Michael J., Dudkin, Vadim Y., Ottinger, Elizabeth A., Getty, Krista L., Zuck, Paul D., Kaufhold, Robin M., Hepler, Robert W., McGaughey, Georgia B., Citron, Michael, Hrin, Renee C., Wang, Ying-Jie, Miller, Michael D., Joyce, Joseph G.
Publicado em 2010

D3R Grand Challenge 4: Blind Prediction of Protein-Ligand Poses, Affinity Rankings, and Relative Binding Free Energies

Por Parks, Conor D., Gaieb, Zied, Chiu, Michael, Yang, Huanwang, Shao, Chenghua, Walters, W. Patrick, Jansen, Johanna M., McGaughey, Georgia, Lewis, Richard A., Bembenek, Scott D., Ameriks, Michael K., Mirzadegan, Tara, Burley, Stephen K., Amaro, Rommie E., Gilson, Michael K.
Publicado no J Comput Aided Mol Des (2020)

Distinct Mutation Pathways of Non-Subtype B HIV-1 during In Vitro Resistance Selection with Nonnucleoside Reverse Transcriptase Inhibitors

Por Lai, Ming-Tain, Lu, Meiqing, Felock, Peter J., Hrin, Renee C., Wang, Ying-Jie, Yan, Youwei, Munshi, Sanjeev, McGaughey, Georgia B., Tynebor, Robert M., Tucker, Thomas J., Williams, Theresa M., Grobler, Jay A., Hazuda, Daria J., McKenna, Philip M., Miller, Michael D.
Publicado em 2010

Antiviral Activity and In Vitro Mutation Development Pathways of MK-6186, a Novel Nonnucleoside Reverse Transcriptase Inhibitor

Por Lu, Meiqing, Felock, Peter J., Munshi, Vandna, Hrin, Renee C., Wang, Ying-Jie, Yan, Youwei, Munshi, Sanjeev, McGaughey, Georgia B., Gomez, Robert, Anthony, Neville J., Williams, Theresa M., Grobler, Jay A., Hazuda, Daria J., McKenna, Philip M., Miller, Michael D., Lai, Ming-Tain
Publicado em 2012

Discovery of 4,4-Disubstituted Quinazolin-2-ones as T-Type Calcium Channel Antagonists

Por Barrow, James C., Rittle, Kenneth E., Reger, Thomas S., Yang, Zhi-Qiang, Bondiskey, Phung, McGaughey, Georgia B., Bock, Mark G., Hartman, George D., Tang, Cuyue, Ballard, Jeanine, Kuo, Yuhsin, Prueksaritanont, Thomayant, Nuss, Cindy E., Doran, Scott M., Fox, Steven V., Garson, Susan L., Kraus, Richard L., Li, Yuxing, Marino, Michael J., Kuzmick Graufelds, Valerie, Uebele, Victor N., Renger, John J.
Publicado em 2010