A Distributional Model of Bound Ligand Conformational Strain: From Small Molecules up to Large Peptidic Macrocycles

por Jain, Ajay N., Brueckner, Alexander C., Cleves, Ann E., Reibarkh, Mikhail, Sherer, Edward C.
Publicado 2023

Influence of Sample Wetting Method on ESC-Behavior of PMMA under Dynamic Fatigue Crack Propagation

por Bubmann, Tobias, Shi, Simon, Brueckner, Alexander, Menzel, Teresa, Ruckdäschel, Holger, Schlarb, Alois K., Altstädt, Volker
Publicado 2022

Computational and Experimental Evidence of Emergent Equilibrium Isotope Effects in Anion Receptor Complexes

por Tresca, Blakely W., Brueckner, Alexander C., Haley, Michael M., Cheong, Paul H.-Y., Johnson, Darren W.
Publicado 2017

Complex peptide macrocycle optimization: combining NMR restraints with conformational analysis to guide structure-based and ligand-based design

por Jain, Ajay N., Brueckner, Alexander C., Jorge, Christine, Cleves, Ann E., Khandelwal, Purnima, Cortes, Janet Caceres, Mueller, Luciano
Publicado 2023

Mechanism and origins of selectivity in the enantioselective oxa-Pictet–Spengler reaction: a cooperative catalytic complex from a hydrogen bond donor and chiral phosphoric acid

por Maskeri, Mark A., Brueckner, Alexander C., Feoktistova, Taisiia, O'Connor, Matthew J., Walden, Daniel M., Cheong, Paul Ha-Yeon, Scheidt, Karl A.
Publicado 2020

Connecting remote C–H bond functionalization and decarboxylative coupling using simple amines

por de Azambuja, Francisco, Yang, Ming-Hsiu, Feoktistova, Taisiia, Selvaraju, Manikandan, Brueckner, Alexander C., Grove, Markas A., Koley, Suvajit, Cheong, Paul Ha-Yeon, Altman, Ryan A.
Publicado 2020

Catalytic Enantioselective [2,3]-Rearrangements of Allylic Ammonium Ylides: A Mechanistic and Computational Study

por West, Thomas H., Walden, Daniel M., Taylor, James E., Brueckner, Alexander C., Johnston, Ryne C., Cheong, Paul Ha-Yeon, Lloyd-Jones, Guy C., Smith, Andrew D.
Publicado 2017

Catalytic enantioselective synthesis of perfluoroalkyl-substituted β-lactones via a concerted asynchronous [2 + 2] cycloaddition: a synthetic and computational study

por Barrios Antúnez, Diego-Javier, Greenhalgh, Mark D., Brueckner, Alexander C., Walden, Daniel M., Elías-Rodríguez, Pilar, Roberts, Patrick, Young, Benjamin G., West, Thomas H., Slawin, Alexandra M. Z., Ha-Yeon Cheong, Paul, Smith, Andrew D.
Publicado 2019