Proofreading experimentally assigned stereochemistry through Q2MM predictions in Pd-catalyzed allylic aminations von Wahlers, Jessica, Margalef, Jèssica, Hansen, Eric, Bayesteh, Armita, Helquist, Paul, Diéguez, Montserrat, Pàmies, Oscar, Wiest, Olaf, Norrby, Per-Ola

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Solvation Structure and Concentration in Glyme-Based Sodium Electrolytes: A Combined Spectroscopic and Computational Study von Wahlers, Jessica, Fulfer, Kristen D, Harding, Drew P, Kuroda, Daniel G, Kumar, Revati, Jorn, Ryan

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Application of Q2MM to predictions in stereoselective synthesis von Rosales, Anthony R, Quinn, Taylor R, Wahlers, Jessica, Tomberg, Anna, Zhang, Xin, Helquist, Paul, Wiest, Olaf, Norrby, Per-Ola

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Rapid virtual screening of enantioselective catalysts using CatVS von Rosales, Anthony R., Wahlers, Jessica, Limé, Elaine, Meadows, Rebecca E., Leslie, Kevin W., Savin, Rhona, Bell, Fiona, Hansen, Eric, Helquist, Paul, Munday, Rachel H., Wiest, Olaf, Norrby, Per-Ola

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On the use of real-world datasets for reaction yield prediction von Saebi, Mandana, Nan, Bozhao, Herr, John E, Wahlers, Jessica, Guo, Zhichun, Zura ski, Andrzej M, Kogej, Thierry, Norrby, Per-Ola, Doyle, Abigail G, Chawla, Nitesh V, Wiest, Olaf

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A Quantum-Guided Molecular Mechanics Force Field for the Ferrocene Scaffold von Wahlers, Jessica, Rosales, Anthony R., Berkel, Neil, Forbes, Aaron, Helquist, Paul, Norrby, Per-Ola, Wiest, Olaf

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Stereoselectivity Predictions for the Pd-Catalyzed 1,4-Conjugate Addition Using Quantum-Guided Molecular Mechanics von Wahlers, Jessica, Maloney, Michael, Salahi, Farbod, Rosales, Anthony R, Helquist, Paul, Norrby, Per-Ola, Wiest, Olaf

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INHIBITORS OF SOLUTE CARRIER FAMILY 6A MEMBER 19 (SLC6A19) AND METHODS OF USE THEREOF von ZIEBENHAUS, Chris, LEE, Patrick Sang Tae, FASTMAN, Nathan, MELLEM, Kevin, KARMEL, Caleb Henry, COOPER, Nicole, MORGANS, JR, SCHAMMEL, Alexander Wayne, MACIAS, Maximiliano De La Higuera, TZITZILONIS, Christos, WAHLERS, Jessica, LIU, Yuxi, PITZEN, Jennifer, REID, Adam Neil, SINZ, Christopher Joseph

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INHIBITORS OF SOLUTE CARRIER FAMILY 6A MEMBER 19 (SLC6A19) AND METHODS OF USE THEREOF von ZIEBENHAUS, Chris, LEE, Patrick Sang Tae, FASTMAN, Nathan, MELLEM, Kevin, KARMEL, Caleb Henry, COOPER, Nicole, MORGANS, JR, SCHAMMEL, Alexander Wayne, MACIAS, Maximiliano De La Higuera, TZITZILONIS, Christos, WAHLERS, Jessica, LIU, Yuxi, PITZEN, Jennifer, REID, Adam Neil, SINZ, Christopher Joseph

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