Protein Structure Refinement of CASP Target Proteins Using GNEIMO Torsional Dynamics Method

por Larsen, Adrien B., Wagner, Jeffrey R., Jain, Abhinandan, Vaidehi, Nagarajan
Publicado 2014

Emerging Computational Methods for the Rational Discovery of Allosteric Drugs

por Wagner, Jeffrey R., Lee, Christopher T., Durrant, Jacob D., Malmstrom, Robert D., Feher, Victoria A., Amaro, Rommie E.
Publicado 2016

Global assessment improves risk stratification for major adverse cardiac events across a wide range of triglyceride levels: Insights from the KP REACH study

por Wagner, Jeffrey R., Fitzpatrick, Jesse K., Yang, Jingrong, Sung, Sue Hee, Allen, Amanda R., Philip, Sephy, Granowitz, Craig, Abrahamson, David, Ambrosy, Andrew P., Go, Alan S.
Publicado 2022

Development and Benchmarking of Open Force Field 2.0.0: The Sage Small Molecule Force Field

por Boothroyd, Simon, Behara, Pavan Kumar, Madin, Owen C., Hahn, David F., Jang, Hyesu, Gapsys, Vytautas, Wagner, Jeffrey R., Horton, Joshua T., Dotson, David L., Thompson, Matthew W., Maat, Jessica, Gokey, Trevor, Wang, Lee-Ping, Cole, Daniel J., Gilson, Michael K., Chodera, John D., Bayly, Christopher I., Shirts, Michael R., Mobley, David L.
Publicado 2023