Search Results - "Foster, Theresa J"

CHARMM Additive All-Atom Force Field for Carbohydrate Derivatives and Its Utility in Polysaccharide and Carbohydrate–Protein Modeling by Guvench, Olgun, Mallajosyula, Sairam S, Raman, E. Prabhu, Hatcher, Elizabeth, Vanommeslaeghe, Kenno, Foster, Theresa J, Jamison, Francis W, MacKerell, Alexander D

“…Monosaccharide derivatives such as xylose, fucose, N-acetylglucosamine (GlcNAc), N-acetylgalactosamine (GlaNAc), glucuronic acid, iduronic acid, and…”
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Balancing target flexibility and target denaturation in computational fragment-based inhibitor discovery by Foster, Theresa J., MacKerell Jr, Alexander D., Guvench, Olgun

“…Accounting for target flexibility and selecting “hot spots” most likely to be able to bind an inhibitor continue to be challenges in the field of…”
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Mechanism of Binding Site Conformational Switching in the CD44–Hyaluronan Protein–Carbohydrate Binding Interaction by Jamison, Francis W., Foster, Theresa J., Barker, Jacob A., Hills, Ronald D., Guvench, Olgun

“…The transmembrane protein CD44, which has been implicated in cancer biology and inflammation, mediates cell adhesion through multimeric interactions with the…”
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Binding Site Flexibility in the CD44:Hyaluronan Protein:Carbohydrate Interaction by Jamison, Francis W., Foster, Theresa J., Barker, Jacob A., Hills, Ronald D., Guvench, Olgun

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