Computational Enzyme Design von Kiss, Gert, Çelebi-Ölçüm, Nihan, Moretti, Rocco, Baker, David, Houk, K. N.

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Towards simple kinetic models of functional dynamics for a kinase subfamily von Sultan, Mohammad M., Kiss, Gert, Pande, Vijay S.

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RAS nucleotide cycling underlies the SHP2 phosphatase dependence of mutant BRAF-, NF1- and RAS-driven cancers von Nichols, Robert J., Haderk, Franziska, Stahlhut, Carlos, Schulze, Christopher J., Hemmati, Golzar, Wildes, David, Tzitzilonis, Christos, Mordec, Kasia, Marquez, Abby, Romero, Jason, Hsieh, Tientien, Zaman, Aubhishek, Olivas, Victor, McCoach, Caroline, Blakely, Collin M., Wang, Zhengping, Kiss, Gert, Koltun, Elena S., Gill, Adrian L., Singh, Mallika, Goldsmith, Mark A., Smith, Jacqueline A. M., Bivona, Trever G.

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Iterative approach to computational enzyme design von Privett, Heidi K, Kiss, Gert, Lee, Toni M, Blomberg, Rebecca, Chica, Roberto A, Thomas, Leonard M, Hilvert, Donald, Houk, Kendall N, Mayo, Stephen L

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Computational Design of an Enzyme Catalyst for a Stereoselective Bimolecular Diels-Alder Reaction von Siegel, Justin B, Zanghellini, Alexandre, Lovick, Helena M, Kiss, Gert, Lambert, Abigail R, St.Clair, Jennifer L, Gallaher, Jasmine L, Hilvert, Donald, Gelb, Michael H, Stoddard, Barry L, Houk, Kendall N, Michael, Forrest E, Baker, David

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Discovery of a regioselectivity switch in nitrating P450s guided by molecular dynamics simulations and Markov models von Dodani, Sheel C., Kiss, Gert, Cahn, Jackson K. B., Su, Ye, Pande, Vijay S., Arnold, Frances H.

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Bridging the gaps in design methodologies by evolutionary optimization of the stability and proficiency of designed Kemp eliminase KE59 von Khersonsky, Olga, Kiss, Gert, Röthlisberger, Daniela, Dym, Orly, Albeck, Shira, Houk, Kendall N, Baker, David, Tawfik, Dan S

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Selective inhibitors of mTORC1 activate 4EBP1 and suppress tumor growth von Lee, Bianca J., Boyer, Jacob A., Burnett, G. Leslie, Thottumkara, Arun P., Tibrewal, Nidhi, Wilson, Stacy L., Hsieh, Tientien, Marquez, Abby, Lorenzana, Edward G., Evans, James W., Hulea, Laura, Kiss, Gert, Liu, Hui, Lee, Dong, Larsson, Ola, McLaughlan, Shannon, Topisirovic, Ivan, Wang, Zhengping, Wang, Zhican, Zhao, Yongyuan, Wildes, David, Aggen, James B., Singh, Mallika, Gill, Adrian L., Smith, Jacqueline A. M., Rosen, Neal

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Identification of significantly mutated regions across cancer types highlights a rich landscape of functional molecular alterations von Araya, Carlos L, Cenik, Can, Reuter, Jason A, Kiss, Gert, Pande, Vijay S, Snyder, Michael P, Greenleaf, William J

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Evaluation and ranking of enzyme designs von Kiss, Gert, Röthlisberger, Daniela, Baker, David, Houk, K. N.

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Automatic Selection of Order Parameters in the Analysis of Large Scale Molecular Dynamics Simulations von Sultan, Mohammad M, Kiss, Gert, Shukla, Diwakar, Pande, Vijay S

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Author Correction: Selective inhibitors of mTORC1 activate 4EBP1 and suppress tumor growth von Lee, Bianca J., Boyer, Jacob A., Burnett, G. Leslie, Thottumkara, Arun P., Tibrewal, Nidhi, Wilson, Stacy L., Hsieh, Tientien, Marquez, Abby, Lorenzana, Edward G., Evans, James W., Hulea, Laura, Kiss, Gert, Liu, Hui, Lee, Dong, Larsson, Ola, McLaughlan, Shannon, Topisirovic, Ivan, Wang, Zhengping, Wang, Zhican, Zhao, Yongyuan, Wildes, David, Aggen, James B., Singh, Mallika, Gill, Adrian L., Smith, Jacqueline A. M., Rosen, Neal

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Author Correction: Selective inhibitors of mTORC1 activate 4EBP1 and suppress tumor growth von Lee, Bianca J., Boyer, Jacob A., Burnett, G. Leslie, Thottumkara, Arun P., Tibrewal, Nidhi, Wilson, Stacy L., Hsieh, Tientien, Marquez, Abby, Lorenzana, Edward G., Evans, James W., Hulea, Laura, Kiss, Gert, Liu, Hui, Lee, Dong, Larsson, Ola, McLaughlan, Shannon, Topisirovic, Ivan, Wang, Zhengping, Wang, Zhican, Zhao, Yongyuan, Wildes, David, Aggen, James B., Singh, Mallika, Gill, Adrian L., Smith, Jacqueline A. M., Rosen, Neal

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Spiroligozymes for Transesterifications: Design and Relationship of Structure to Activity von Kheirabadi, Mahboubeh, Çelebi-Ölçüm, Nihan, Parker, Matthew F. L, Zhao, Qingquan, Kiss, Gert, Houk, K. N, Schafmeister, Christian E

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Optimization of the In-Silico-Designed Kemp Eliminase KE70 by Computational Design and Directed Evolution von Khersonsky, Olga, Röthlisberger, Daniela, Wollacott, Andrew M., Murphy, Paul, Dym, Orly, Albeck, Shira, Kiss, Gert, Houk, K.N., Baker, David, Tawfik, Dan S.

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Discovery of RMC-5552, a Selective Bi-Steric Inhibitor of mTORC1, for the Treatment of mTORC1-Activated Tumors von Burnett, G. Leslie, Yang, Yu C., Aggen, James B., Pitzen, Jennifer, Gliedt, Micah K., Semko, Chris M., Marquez, Abby, Evans, James W., Wang, Gang, Won, Walter S., Tomlinson, Aidan C. A., Kiss, Gert, Tzitzilonis, Christos, Thottumkara, Arun P., Cregg, James, Mellem, Kevin T., Choi, Jong S., Lee, Julie C., Zhao, Yongyuan, Lee, Bianca J., Meyerowitz, Justin G., Knox, John E., Jiang, Jingjing, Wang, Zhican, Wildes, David, Wang, Zhengping, Singh, Mallika, Smith, Jacqueline A. M., Gill, Adrian L.

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Biolayer Interferometry Assay for Cyclin-Dependent Kinase-Cyclin Association Reveals Diverse Effects of Cdk2 Inhibitors on Cyclin Binding Kinetics von Tambo, Carrie S., Tripathi, Sarvind, Perera, B. Gayani K., Maly, Dustin J., Bridges, Alexander J., Kiss, Gert, Rubin, Seth M.

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Computational Design of Catalytic Dyads and Oxyanion Holes for Ester Hydrolysis von Richter, Florian, Blomberg, Rebecca, Khare, Sagar D, Kiss, Gert, Kuzin, Alexandre P, Smith, Adam J. T, Gallaher, Jasmine, Pianowski, Zbigniew, Helgeson, Roger C, Grjasnow, Alexej, Xiao, Rong, Seetharaman, Jayaraman, Su, Min, Vorobiev, Sergey, Lew, Scott, Forouhar, Farhad, Kornhaber, Gregory J, Hunt, John F, Montelione, Gaetano T, Tong, Liang, Houk, K. N, Hilvert, Donald, Baker, David

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Selective inhibitors of mTORC1 activate 4EBP1 and suppress tumor growth (Jun, 10.1038/s41589-021-00813-7, 2021) von Lee, Bianca J., Boyer, Jacob A., Burnett, G. Leslie, Thottumkara, Arun P., Tibrewal, Nidhi, Wilson, Stacy L., Hsieh, Tientien, Marquez, Abby, Lorenzana, Edward G., Evans, James W., Hulea, Laura, Kiss, Gert, Liu, Hui, Lee, Dong, Larsson, Ola, McLaughlan, Shannon, Topisirovic, Ivan, Wang, Zhengping, Wang, Zhican, Zhao, Yongyuan, Wildes, David, Aggen, James B., Singh, Mallika, Gill, Adrian L., Smith, Jacqueline A. M., Rosen, Neal

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Selective inhibitors of mTORC1 activate 4EBP1 and suppress tumor growth (vol 17, pg 1065, 2021) von Lee, Bianca J., Boyer, Jacob A., Burnett, G. Leslie, Thottumkara, Arun P., Tibrewal, Nidhi, Wilson, Stacy L., Hsieh, Tientien, Marquez, Abby, Lorenzana, Edward G., Evans, James W., Hulea, Laura, Kiss, Gert, Liu, Hui, Lee, Dong, Larsson, Ola, McLaughlan, Shannon, Topisirovic, Ivan, Wang, Zhengping, Wang, Zhican, Zhao, Yongyuan, Wildes, David, Aggen, James B., Singh, Mallika, Gill, Adrian L., Smith, Jacqueline A. M., Rosen, Neal

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