Predicting Stability Constants for Uranyl Complexes Using Density Functional Theory von Vukovic, Sinisa, Hay, Benjamin P, Bryantsev, Vyacheslav S

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Computer-Aided Design of a Sulfate-Encapsulating Receptor von Custelcean, Radu, Bosano, Jerome, Bonnesen, Peter V, Kertesz, Vilmos, Hay, Benjamin P

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De Novo Structure-Based Design of Bis-amidoxime Uranophiles von Vukovic, Sinisa, Hay, Benjamin P

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Urea-Functionalized M4L6 Cage Receptors: Anion-Templated Self-Assembly and Selective Guest Exchange in Aqueous Solutions von Custelcean, Radu, Bonnesen, Peter V, Duncan, Nathan C, Zhang, Xiaohua, Watson, Lori A, Van Berkel, Gary, Parson, Whitney B, Hay, Benjamin P

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Computer-Aided Molecular Design of Bis-phosphine Oxide Lanthanide Extractants von McCann, Billy W., Silva, Nuwan De, Windus, Theresa L., Gordon, Mark S., Moyer, Bruce A., Bryantsev, Vyacheslav S., Hay, Benjamin P.

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Benzene-, Pyrrole-, and Furan-Containing Diametrically Strapped Calix[4]pyrroles--An Experimental and Theoretical Study of Hydrogen-Bonding Effects in Chloride Anion Recognition von Yoon, Dae-Wi, Gross, Dustin E, Lynch, Vincent M, Sessler, Jonathan L, Hay, Benjamin P, Lee, Chang-Hee

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KF and CsF Recognition and Extraction by a Calix[4]crown‑5 Strapped Calix[4]pyrrole Multitopic Receptor von Kim, Sung Kuk, Lynch, Vincent M, Young, Neil J, Hay, Benjamin P, Lee, Chang-Hee, Kim, Jong Seung, Moyer, Bruce A, Sessler, Jonathan L

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Structural Design Criteria for Anion Hosts:  Strategies for Achieving Anion Shape Recognition through the Complementary Placement of Urea Donor Groups von Hay, Benjamin P, Firman, Timothy K, Moyer, Bruce A

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Design Criteria for Polyazine Extractants To Separate AnIII from LnIII von de Sahb, Charles, Watson, Lori A, Nadas, Janos, Hay, Benjamin P

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Controlling Cesium Cation Recognition via Cation Metathesis within an Ion Pair Receptor von Kim, Sung Kuk, Vargas-Zúñiga, Gabriela I, Hay, Benjamin P, Young, Neil J, Delmau, Lætitia H, Masselin, Charles, Lee, Chang-Hee, Kim, Jong Seung, Lynch, Vincent M, Moyer, Bruce A, Sessler, Jonathan L

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Influence of Substituents on the Strength of Aryl C−H···Anion Hydrogen Bonds von Bryantsev, Vyacheslav S, Hay, Benjamin P

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Molecular Dynamics Simulation of Tri-n-butyl-Phosphate Liquid: A Force Field Comparative Study von Cui, Shengting, de Almeida, Valmor F, Hay, Benjamin P, Ye, Xianggui, Khomami, Bamin

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Crystal Structure Evidence for the Directionality of Lone Pair−π interactions: Fact or Fiction? von Jia, Chuandong, Miao, Haohao, Hay, Benjamin P

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Synthesis, Lanthanide Coordination Chemistry, and Liquid–Liquid Extraction Performance of CMPO-Decorated Pyridine and Pyridine N‑Oxide Platforms von Rosario-Amorin, Daniel, Ouizem, Sabrina, Dickie, Diane A, Wen, Yufeng, Paine, Robert T, Gao, Jian, Grey, John K, de Bettencourt-Dias, Ana, Hay, Benjamin P, Delmau, Lætitia H

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Structural design principles for self-assembled coordination polygons and polyhedra von Young, Neil J, Hay, Benjamin P

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Anion-arene adducts: C-H hydrogen bonding, anion-pi interaction, and carbon bonding motifs von Hay, Benjamin P, Bryantsev, Vyacheslav S

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De Novo Structure-Based Design of Bisurea Hosts for Tetrahedral Oxoanion Guests von Bryantsev, Vyacheslav S, Hay, Benjamin P

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How Amidoximate Binds the Uranyl Cation von Vukovic, Sinisa, Watson, Lori A, Kang, Sung Ok, Custelcean, Radu, Hay, Benjamin P

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Synthesis and f-element ligation properties of NCMPO-decorated pyridine N-oxide platforms von Ouizem, Sabrina, Rosario-Amorin, Daniel, Dickie, Diane A, Paine, Robert T, de Bettencourt-Dias, A, Hay, Benjamin P, Podair, Julien, Delmau, Lætitia H

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Synthesis and Coordination Chemistry of Phosphine Oxide Decorated Dibenzofuran Platforms von Rosario-Amorin, Daniel, Duesler, Eileen N, Paine, Robert T, Hay, Benjamin P, Delmau, Lætitia H, Reilly, Sean D, Gaunt, Andrew J, Scott, Brian L

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