Penn Chemistry is a leading center of molecular research. Within the department, the traditional sub-fields of biochemistry, organic, inorganic, and physical chemistry serve as a framework from which collaborative, inter-disciplinary experimental and theoretical research is launched. Research thrusts include:

  • Synthesis and Characterization of New Compounds and Materials
  • Chemistry of Life Processes
  • Nanoscale Materials and Molecular Devices
  • Chemistry of the Environment
  • Energy and the Hydrogen Economy

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Submissions from 2016

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The Role of Dynamic Ligand Exchange in the Oxidation Chemistry of Cerium(III), Jerome R. Robinson, Yusen Qiao, Jun Gu, Patrick J. Carroll, Patrick J. Walsh, and Eric J. Schelter

Submissions from 2015

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Xe Affinities of Water-Soluble Cryptophanes and the Role of Confined Water, Lu Gao, Wenhao Liu, One-Sun Lee, Ivan J. Dmochowskia, and Jeffery G. Saven

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Molecular Recognition of Ketamine by a Subset of Olfactory G Protein–coupled Receptors, Jianghai Ho, Jose Manuel Perez Aguilar, Lu Gao, Jeffery G. Saven, Hiroaki Matsunami, and Roderic G. Eckenhoff

Submissions from 2014

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Scalable Production of Highly Sensitive Nanosensors Based on Graphene Functionalized With a Designed G Protein-Coupled Receptor, Mitchell Bryant Lerner, Felipe Matsunaga, Gang Hee Han, Sung Ju Hong, Jin Xi, Alexander Crook, Jose Manuel Perez Aguilar, Yung Woo Park, Jeffery G. Saven, Renyu Liu, and A. T. Charlie Johnson

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Characterization of a Computationally Designed Water-Soluble Human μ Opioid Receptor Variant Using X-ray Structural Information, Xuelian Zhao, Jose Manuel Perez Aguilar, Felipe Matsunaga, Mitchell Bryant Lerner, Jin Xi, Bernard Selling, A. T. Charlie Johnson, Jeffery G. Saven, and Renyu Liu

Submissions from 2013

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Computational De Novo Design and Characterization of a Protein That Selectively Binds a Highly Hyperpolarizable Abiological Chromophore, H Christopher Fry, Andreas Lehmann, Louise E. Sinks, Inge Asselberghs, Andrey Tronin, Venkata Krishnan, J Kent Blasie, Koen Clays, William F. DeGrado, Jeffery G. Saven, and Michael J. Therien

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A Computationally Designed Water-Soluble Variant of a G-Protein-Coupled Receptor: The Human Mu Opioid Receptor, Jose Manuel Perez Aguilar, Jin Xi, Felipe Matsunaga, Xu Cui, Bernard Selling, Jeffery G. Saven, and Renyu Liu

Submissions from 2012

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NMR Structure and Dynamics of a Designed Water-Soluble Transmembrane Domain of Nicotinic Acetylcholine Receptor, Tanxing Cui, David Mowrey, Vasyl Bondarenko, Tommy Tillman, Dejian Ma, Elizabeth Landrum, Jose Manuel Perez Aguilar, Jing He, Wei Wang, Jeffery G. Saven, Roderic G. Eckenhoff, Pei Tang, and Yan Xu

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Computational Design of a Protein Crystal, Christopher J Lanci, Christopher M MacDermaid, Seung-gu Keng, Rudresh Acharya, Benjamin North, Xi Yang, X Jade Qiu, William F. DeGrado, and Jeffery G. Saven

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Binding Site and Affinity Prediction of General Anesthetics to Protein Targets Using Docking, Renyu Liu, Jose Manuel Perez Aguilar, David Liang, and Jeffery G. Saven

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Computational Design of Membrane Proteins, Jose Manuel Perez Aguilar and Jeffery G. Saven

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Human μ Opioid Receptor Models with Evaluation of the Accuracy Using the Crystal Structure of the Murine μ Opioid Receptor, Jose Manuel Perez Aguilar, Jeffery G. Saven, and Renyu Liu

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Knowledge-Based Potential for Positioning Membrane-Associated Structures and Assessing Residue-Specific Energetic Contributions, Chaim A Schramm, Brett Thomas Hannigan, Jason E. Donald, Chen Keasar, Jeffery G. Saven, William F. DeGrado, and Ilan Samish

Submissions from 2011

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Computational Protein Design to Re-Engineer Stromal Cell-Derived Factor-1α (SDF) Generates an Effective and Translatable Angiogenic Polypeptide Analog, William Hiesinger, Jose Manuel Perez Aguilar, Pavan Atluri, Nicole A. Marotta, John R. Frederick, J Raymond Fitzpatrick, Ryan C. McCormick, Jeffrey R. Muenzer, Elaine C. Yang, Rebecca D. Levit, Li-Jun Yuan, John W. Macarthur, Jeffery G. Saven, and Y Joseph Woo

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Computational Protein Design: Engineering Molecular Diversity, Nonnatural Enzymes, Nonbiological Cofactor Complexes, and Membrane Proteins, Jeffery G. Saven

Submissions from 2010

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Computational Design and Elaboration of a De Novo Heterotetrameric α-Helical Protein that Selectively Binds an Emissive Abiological (Porphinato)zinc Chromophore, H Christopher Fry, Andreas Lehmann, Jeffery G. Saven, William F. DeGrado, and Michael J. Therien

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Computational Protein Design: Advances in the Design and Redesign of Biomolecular Nanostructures, Jeffery G. Saven

Submissions from 2009

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Identification of the Active Form of Endothelial Lipase, a Homodimer in a Head-to-Tail Conformation, Nathalie Griffon, Weijin Jin, Thomas John Petty II, John Millar, Karen O. Badellino, Jeffery G. Saven, Dawn H. Marchadier, Ellis S. Kempner, Jeffrey Billheimer, Jane M. Glick, and Daniel J. Rader

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Structural Coupling Between FKBP12 and Buried Water, Szilvia Szep, Sheldon Park, Eric T Boder, Gregory D Van Duyne, and Jeffery G. Saven

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Characterization of Cofactor-Induced Folding Mechanism of a Zinc Binding Peptide Using Computationally Designed Mutants, Jia Tang, Seung-Gu Kang, Jeffery G. Saven, and Feng Gai

Submissions from 2008

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Using α-Helical Coiled-Coils to Design Nanostructured Metalloporphyrin Arrays, Karen A. McAllister, Hongling Zou, Frank V. Cochran, Gretchen M Bender, Alessandro Senes, H Christopher Fry, Vikas Nanda, Patricia A. Keenan, James D. Lear, Jeffery G. Saven, Michael J. Therien, J Kent Blasie, and William F. DeGrado

Submissions from 2007

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De Novo Design of a Single Chain Diphenylporphyrin Metalloprotein, Gretchen M Bender, Andreas Lehmann, Hongling Zou, Hong Cheng, H Christopher Fry, Don Engel, Michael J. Therien, J Kent Blasie, Heinrich Roder, Jeffery G. Saven, and William F. DeGrado

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Fluorescence Correlation Spectroscopic Study of Serpin Depolymerization by Computationally Designed Peptides, Pramit Chowdhury, Wei Wang, Stacey Lavender, Michelle R Bunagan, Jason W. Klemke, Jia Tang, Jeffery G. Saven, Barry S. Cooperman, and Feng Gai

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A Focused Antibody Library for Selecting scFvs Expressed at High Levels in the Cytoplasm, Pascal Philbert, Audrey Stoessel, Wei Wang, Annie-Paule Sibler, Nicole Bec, Christian Larroque, Jeffery G. Saven, Jérôme Courtête, Etienne Weiss, and Pierre Martineau

Submissions from 2004

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Computational Design of Water-Soluble Analogues of the Potassium Channel KcsA, Avram Michael Slovic, Hidetoshi Kono, James D. Lear, Jeffery G. Saven, and William F. DeGrado

Submissions from 2001

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Statistical Theory of Protein Combinatorial Libraries, Hidetoshi Kono, Jinming Zou, and Jeffery G. Saven