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2014

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Less Cookbook and More Research! Synthetic Efforts Toward JBIR-94 and JBIR-125: a Student-Designed Research Project in a Sophomore Organic Chemistry Lab, Mike A. Christiansen, C. L. Crawford, and C. D. Mangum; The Chemical Educator

2013

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Understanding precision nitrogen stress to optimize the growth and lipid content tradeoff in oleaginous green microalgae, Curtis Adams, Valerie Godfrey, Bruce Bugbee, Brad Wahlen, and Lance Seefeldt; Bioresource Technology

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An Electrolysis Experiment for a Middle School Summer Science Camp, Mike A. Christiansen, Leslie Jessup, and Kevin D. Woodward; An Electrolysis Experiment for a Middle School Summer Science Camp

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Investigation of Antibacterial Mode of Action for Traditional and Amphiphilic Aminoglycosides, Venkatareddy Udumula, Young Wan Ham, Marina Y. Fosso, Ka Yee Chan, Ravi Rai, Jianjun Zhang, Jie Li, and Cheng-Wei Tom Chang; Bioorganic & Medicinal Chemistry Letters

2012

A 3‐dimensional time‐resolved photothermal deflection “Mirage” method, N. G.C. Astrath, L. C. Malacarne, G. V.B. Lukasievicz, H. S. Bernabe, J. H. Rohling, M. L. Baesso, J. Shen, and Stephen E. Bialkowski; Applied Physics Letters

A 3‐dimensional time‐resolved photothermal deflection “Mirage” method, N. G.C. Astrath, L. C. Malacarne, G. V.B. Lukasievicz, H. S. Bernabe, J. H. Rohling, M. L. Baesso, J. Shen, and Stephen E. Bialkowski; Applied Physics Letters

The molecular details of WPD-loop movement differ in the protein-tyrosine phosphatases YopH and PTP1B, Tiago A.S. Brandão, Alvan C. Hengge, and Sean J. Johnson; Archives of Biochemistry and Biophysics

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BOTPPI, a New Wittig Salt Used in the Synthesis of 12-(S)-Hydroxy-Eicosatetraenoic Acid [12-(S)-HETE], M. A. Christiansen and M. B. Andrus; Tetrahedron Lett.

A Theoretical and Experimental Study of Time‐Resolved Thermal Mirror with Non‐Absorbing Heat Coupling Fluids , Gustavo V.B. Lukasievicz, Luis C. Malacarne, Nelson G.C. Astrath, Vitor S. Zanuto, Leandro S. Herculano, and Stephen E. Bialkowski; Applied Spectroscopy

2011

Synthesis of Substrates to Probe the Biochemistry of the Ecteinascidin 743 (ET-743) Biosynthetic Gene Cluster, M. A. Christiansen, A. Jimenez-Somarribas, C. M. Rath, R. M. Williams, and D. H. Sherman; Organic & Biomolecular Chemistry

A Compact Pulsed Infrared Laser Excited Photothermal Deflection Spectrometer, Oluwatosin O. Dada and Stephen E. Bialkowski; Applied Spectroscopy

A Compact Pulsed Infrared Laser Excited Photothermal Deflection Spectrometer, Oluwatosin O. Dada and Stephen E. Bialkowski; Applied Spectroscopy

Time‐Resolved Thermal Lens and Thermal Mirror Spectroscopies with Sample‐Fluid Heat Coupling: A Complete Model for Material Characterization, Luis C. Malacarne, Nelson G.C. Astrath, Gustavo V.B. Lukasievicz, Ervin K. Lenzi, Mauro L. Baesso, and Stephen E. Bialkowski; Applied Spectroscopy

Time‐Resolved Thermal Lens and Thermal Mirror Spectroscopies with Sample‐Fluid Heat Coupling: A Complete Model for Material Characterization, Luis C. Malacarne, Nelson G.C. Astrath, Gustavo V.B. Lukasievicz, Ervin K. Lenzi, Mauro L. Baesso, and Stephen E. Bialkowski; Applied Spectroscopy

Meta-omic characterization of the marine invertebrate microbial consortium that produces the chemotherapeutic natural product ET-743, C. M. Rath, B. Janto, J. Earl, A. Ahmed, F. A. Hu, L. Hiller, M. Dahlgren, R. Kreft, F. Yu, J. J. Wolff, H. K. Kweon, M. A. Christiansen, K. Hakansson, R. M. Williams, G. D. Ehrlich, and D. H. Sherman; ACS Chemical Biology

Insights into the Phosphoryl Transfer Mechanism of Cyclin-Dependent Protein Kinases from ab Initio QM/MM Free-Energy Studies, Gregory K. Smith, Zhihong Ke, Hua Guo, and Alvan C. Hengge; Journal of Physical Chemistry B

2010

Definition of the Hydrogen Bond, E. Arunan, G. R. Desiraju, R. A. Klein, J. Sadlej, Steve Scheiner, I. Alkorta, D. C. Clary, R. H. Crabtree, J. J. Duannenberg, P. Hobza, H. G. Kiaergaard, A. C. Legon, B. Mennucci, and D. J. Nesbitt

Pulsed‐Laser Excited Thermal Lens Spectroscopy With Sample‐Fluid Heat Coupling, G. C. Astrath, Luis C. Malacarne, Paulo R.B. Pedreira, Marcos P. Belancon, Mauro L. Baesso, Prakash R. Joshi, and Stephen E. Bialkowski; Journal of Applied Physics

Pulsed‐Laser Excited Thermal Lens Spectroscopy With Sample‐Fluid Heat Coupling, G. C. Astrath, Luis C. Malacarne, Paulo R.B. Pedreira, Marcos P. Belancon, Mauro L. Baesso, Prakash R. Joshi, and Stephen E. Bialkowski; Journal of Applied Physics

Phosphoryl and Sulfuryl Transfer, Tiago A.S. Brandão and Alvan C. Hengge; Comprehensive Natural Products II: Chemistry and Biology

Insights into the Reaction of Proteintyrosine Phosphatase 1B: Crystal Structures for Transition State Analogs of Both Catalytic Steps, Tiago A.S. Brandão, Alvan C. Hengge, and Sean J. Johnson; Journal of Biological Chemistry

Pulsed Laser Excited Photothermal Lens Spectrometry of Cadmium Sulfoselenide Doped Silica Glasses, Prakash R. Joshi, Oluwatosin Dada, and Stephen E. Bialkowski; Journal of Physics: Conference Series

Pulsed Laser Excited Photothermal Lens Spectrometry of Cadmium Sulfoselenide Doped Silica Glasses, Prakash R. Joshi, Oluwatosin Dada, and Stephen E. Bialkowski; Journal of Physics: Conference Series

Analytical Solution for Mode‐Mismatched Thermal Lens Spectroscopy with Sample‐Fluid Heat Coupling, Luis C. Malacarne, Nelson G.C. Astrath, Paulo R.B. Pedreira, Renio S. Mendes, Mauro L. Baesso, Prakash R. Joshi, and Stephen E. Bialkowski; Journal of Applied Physics

Analytical Solution for Mode‐Mismatched Thermal Lens Spectroscopy with Sample‐Fluid Heat Coupling, Luis C. Malacarne, Nelson G.C. Astrath, Paulo R.B. Pedreira, Renio S. Mendes, Mauro L. Baesso, Prakash R. Joshi, and Stephen E. Bialkowski; Journal of Applied Physics

The Divalent Metal Ion in the Active Site of Uteroferrin Modulates Substrate Binding and Catalysis, Natasa Mitic, Kieran S. Hadler, Lawrence R. Gahan, Alvan C. Hengge, and Gerhard Schenk; Journal of the American Chemical Society

Cooperativity of Multiple H-Bonds in Influencing Structural and Spectroscopic Features of the Peptide Unit of Proteins, Steve Scheiner; Journal of Molecular Structure

MacMillan Encyclopedia of Chemistry, Steve Scheiner

Review of: The Nature of the Hydrogen Bond, by G. Gilli and P. Gilli, Steve Scheiner; International Journal of Quantum Chemistry

Theoretical Analysis of the Contributions Made by CH∙∙O H-bonds to Protein Structure, Steve Scheiner

Unconventional H-bonds: SH∙∙∙N Interaction, M. Solimannejad and Steve Scheiner; International Journal of Quantum Chemistry

2009

Phase-Transfer Catalyzed Asymmetric Arylacetate Alkylation, M. B. Andrus, K. C. Harper, M. A. Christiansen, and M. A. Binkley; Synfacts

Phase-Transfer Catalyzed Asymmetric Arylacetate Alkylation, M. B. Andrus, K. C. Harper, M. A. Christiansen, and M. A. Binkley; Tetrahedron Letters

Impaired acid catalysis by mutation of a protein loop hinge residue in a YopH mutant revealed by crystal structures, T. A.S. Brandão, H. Robinson, S. J. Johnson, and Alvan C. Hengge; Journal of the American Chemical Society

Synthesis of Kurasoin B Using Phase-Transfer-Catalyzed Acylimidazole Alkylation, M. A. Christiansen, A. W. Butler, A. R. Hill, and M. B. Andrus; Synlett

Mechanism and Transition State Structure of Aryl Methylphosphonate Esters Doubly Coordinated to a Dinuclear Cobalt(III) Center, Guoqiang Feng, Eric A. Tanifum, Harry Adams, Alvan C. Hengge, and Nicholas H. Williams; Journal of the American Chemical Society

The Heat Capacities and Standard Entropies of Corresponding Potassium and Ammonium Ion Species: Is There a Constant Difference?, H. D. B. Jenkins, J. F. Liebman, M. Ponkivar, and Steve Scheiner; Structural Chemistry

Pulsed‐Laser Excited Photothermal Study of Cadmium Sulfoselenium Nanoparticle Doped Glasses, Prakash R. Joshi, Oluwatosin Dada, and Stephen E. Bialkowski; Applied Spectroscopy

Pulsed‐Laser Excited Photothermal Study of Cadmium Sulfoselenium Nanoparticle Doped Glasses, Prakash R. Joshi, Oluwatosin Dada, and Stephen E. Bialkowski; Applied Spectroscopy

Antiproliferative and Protein Kinase Binding Activities of Some N6,5'-Bis-ureido 5'-Amino-5'-deoxyadenosine Derivatives, M. A. Peterson, M. Oliveira, and M. A. Christiansen; Nucleosides, Nucleotides and Nucleic Acids

Preliminary SAR Analysis of Novel Antiproliferative N6,5ˈ-Bis-Ureidoadenosine Derivatives, M. A. Peterson, M. Oliveira, M. A. Christiansen, and C. E. Cutler; Bioorganic & Medicinal Chemistry Letters

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Identification of Spectroscopic Patterns of CH···O H-Bonds in Proteins, Steve Scheiner; Journal of Physical Chemistry B

Ingredients Necessary for Proton Transfer in Enzymes, Steve Scheiner; Israel Journal of Chemistry

Quantum Chemical Analysis of the Energetics of the anti- and gauche- Conformers of Ethanol, Steve Scheiner and P. G. Seybold; Structural Chemistry

Active-Site Dynamics of SpvC Virulence Factor from Salmonella typhimurium and Density Functional Theory Study of Phosphothreonine Lyase Catalysis, Gregory K. Smith, Zhihong Ke, Alvan C. Hengge, Dingguo Xu, Daiqian Xie, and Hua Guo; Journal of Physical Chemistry

Existence and Characterization of HOO-HOOOH Radical-Molecule Complexes: A Computational Study, M. Solimannejad, S. Massahi, and Steve Scheiner; Journal of Molecular Structure: TheoChem

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Nature of Interactions in Open-Shell Complexes Pairing H2X with HXX, X=S,O, Mohammad Solimannejad and Steve Scheiner; Molecular Physics

2008

Development of Infrared Photothermal Deflection Spectroscopy (Mirage Effect) for Analysis of Condensed‐phase Aerosols Collected in a Micro‐Orifice Uniform Deposit Impactor, Oluwatosin Dada and Stephen E. Bialkowski; Applied Spectroscopy

Development of Infrared Photothermal Deflection Spectroscopy (Mirage Effect) for Analysis of Condensed‐phase Aerosols Collected in a Micro‐Orifice Uniform Deposit Impactor, Oluwatosin Dada and Stephen E. Bialkowski; Applied Spectroscopy

Finite Element Analysis Modeling of Pulse‐Laser Excited Photothermal Deflection (Mirage Effect) from Aerosols, Oluwatosin Dada and Stephen E. Bialkowski; Applied Spectroscopy

Finite Element Analysis Modeling of Pulse‐Laser Excited Photothermal Deflection (Mirage Effect) from Aerosols, Oluwatosin Dada and Stephen E. Bialkowski; Applied Spectroscopy

Substrate-Promoted Formation of a Catalytically Competent Binuclear Center and Regulation of Reactivity in a Glycerophosphodiesterase from Enterobacter aerogenes, K. S. Hadler, E. A. Tanifum, S. H.C. Yip, N. Mitic, L. W. Guddat, C. J. Jackson, L. R. Gahan, K. Nguyen, P. D. Carr, D. L. Ollis, Alvan C. Hengge, J. A. Larrabee, and g. Schenk; Journal of the American Chemical Society

An Altered Transition State for the Reaction of an RNA Model Catalyzed by a Dinuclear Zinc(II) Catalyst, T. Humphry, S. Iyer, O. Iranzo, J. R. Morrow, J. P. Richard, Piotr Paneth, and Alvan C. Hengge; Journal of the American Chemical Society

The Effects of Sulfur Substitution for the Nucleophile and Bridging Oxygen Atoms in Reactions of Hydroxyalkyl Phosphate Esters, Subashree Iyer and Alvan C. Hengge; Journal of Organic Chemistry

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Noncovalent π−π Stacking and CH---π Interactions of Aromatics on the Surface of Single-Wall Carbon Nanotubes: An MP2 Study, T. Kar, H. Bettinger, Steve Scheiner, and A. K. Roy; Journal of Physical Chemistry C

Theoretical Investigation of the Mechanism of LiH + NH3 → LiNH2 + H2, T. Kar, Steve Scheiner, and L. Li; Journal of Molecular Structure: TheoChem

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The Effect on Acidity of Size and Shape of Carboxylated Single-Wall Carbon Nanotubes. A DFT-SLDB Study, T. Kar, Steve Scheiner, and A. K. Roy; Chemical Physics Letters

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Bonding Rearrangements of Hydrogen Bonded Complexes involving Alkynes, E. S. Kryachko and Steve Scheiner; Journal of Physical Chemistry A

Structure and Properties of Perfluoroalkylated Phthalocyanines. A Theoretical Study, M.-S. Liao, J. D. Watts, S. M. Gorun, Steve Scheiner, and M.-J. Huang; Journal of Theoretical and Computational Chemistry

Mechanistic Study of Protein Phosphatase-1 (PP1), A Catalytically Promiscuous Enzyme, C. McWhirter, E. A. Lund, E. A. Tanifum, G. Feng, Q. L. Sheikh, Alvan C. Hengge, and N. H. Williams; Journal of the American Chemical Society

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Analysis of Catalytic Mechanism of Serine Proteases. Viability of Ring-Flip Hypothesis, Steve Scheiner; Journal of Physical Chemistry B

Solvation of Hydrogen Bonded Systems: CH··O, OH··O, and Cooperativity, Steve Scheiner

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Spectroscopic and Structural Signature of the CH--O H-Bond, Steve Scheiner and T. Kar; Journal of Phycology

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Complexes Pairing Aliphatic Amines with Hydroxyl and Hydroperoxyl Radicals: A Computational Study, M. Solimannejad, C. J. Neilsen, and Steve Scheiner; Chemical Physics Letters

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Complexes Pairing Hypohalous Acids with Nitrosyl Hydride. Blue Shift of a NH Bond that is Uninvolved in a H-bond, M. Solimannejad and Steve Scheiner; Journal of Physical Chemistry A

2007

Phase-Transfer-Catalyzed Asymmetric Acylimidazole Alkylation, M. B. Andrus, M. A. Christiansen, E. J. Hicken, M. J. Gainer, D. K. Bedke, K. C. Harper, S. R. Mikkelson, D. S. Dodson, and D. T. Harris; Organic Letters

Probing the Origin of the Compromised Catalysis of E. coli Alkaline Phosphatase in its Promiscuous Sulfatase Reaction, Irina Catrina, Patrick J. O'Brien, Jamie Purcell, Ivana Nikolic-Hughes, Jesse G. Zalatan, Alvan C. Hengge, and Daniel Herschlag; Journal of the American Chemical Society

Diesterase Activity and Substrate Binding in Purple Acid Phosphatases, R. S. Cox, G. Schenk, N. Mitic, L. Gahan, and Alvan C. Hengge; Journal of the American Chemical Society

Continuous Laser‐Excited Photothermal Spectrometry of CdSxSe1‐x Doped Glasses, Oluwatosin Dada, Matthew R. Jorgensen, and Stephen E. Bialkowski; Applied Spectroscopy

Continuous Laser‐Excited Photothermal Spectrometry of CdSxSe1‐x Doped Glasses, Oluwatosin Dada, Matthew R. Jorgensen, and Stephen E. Bialkowski; Applied Spectroscopy

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Minimum Energy Pathways for Proton-Transfer between Adjacent Sites Exposed to Water, R. Friedman, S. Fischer, E. Nachliel, Steve Scheiner, and M. Gutman; Journal of Physical Chemistry B

The Use of Isotopes in the Study of Reactions of Acyl, Phosphoryl, and Sulfuryl Esters, R. H. Hoff and Alvan C. Hengge; Journal of Labelled Compounds and Radiopharmaceuticals

Periodicity in Proton Conduction along a H-bonded Chain. Application to Biomolecules, A. Isaev, T. Kar, and Steve Scheiner; International Journal of Quantum Chemistry

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The Strength with Which a Peptide Group Can Form a Hydrogen Bond Varies with the Internal Conformation of the Polypeptide Chain, Steve Scheiner; Journal of Physical Chemistry B

Underlying Source of the Relation between Polypeptide Conformation and Strength of NH··O Hydrogen Bonds, Steve Scheiner and T. Kar; Journal of Molecular Structure

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Theoretical Evidence for a NH···XC Blue-Shifting Hydrogen Bond:  Complexes Pairing Monohalomethanes with HNO, M. Solimannejad and Steve Scheiner; Journal of Physical Chemistry A

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Analysis of Complexes Pairing Hydroperoxyl Radical with Peroxyformic Acid, M. Solimannejad, S. Gh. Shirazi, and Steve Scheiner; Journal of Physical Chemistry A

Mechanism of Rhodium- Catalyzed Carbene Formation from Diazo Compounds, Freeman M. Wong, Jianbo Wang, Alvan C. Hengge, and Weiming Wu; Organic Letters

Kinetic Isotope Effects for Alkaline Phosphatase Reactions: Implications for the Role of Active- Site Metal Ions in Catalysis, J. G. Zalatan, I. Catrina, R. Mitchell, P. K. Grzyska, P. J. O'Brien, D. Herschlag, and Alvan C. Hengge; Journal of the American Chemical Society

2006

Enzymatic Mechanisms of Phosphate and Sulfate Transfer, W. W. Cleland and Alvan C. Hengge; Chemical Reviews

The Transition State of the Sulfuryl Transfer Reaction of Estrogen Sulfotransferase, R. H. Hoff, P. G. Czyryca, M. Sun, T. S. Leyh, and Alvan C. Hengge; Journal of Biological Chemistry

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Cooperativity of Conventional and Unconventional Hydrogen Bonds Involving Imidazole, Tapas Kar and Steve Scheiner; International Journal of Quantum Chemistry

Transesterification Thio Effects of Phosphate Diesters: Free Energy Barriers and Kinetic and Equilibrium Isotope Effects from Density-Functional Theory, Y. Liu, A. Gregersen, Alvan C. Hengge, and D. M. York; Biochemistry

Metal-Catalyzed Phosphodiester Cleavage: Secondary 18O Isotope Effects as an Indicator of Mechanism, J. Rawlings, W. W. Cleland, and Alvan C. Hengge; Journal of the American Chemical Society

Contribution of CH··X Hydrogen Bonds to Biomolecular Structure, Steve Scheiner

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Contributions of NH···O and CH···O Hydrogen Bonds to the Stability of β-Sheets in Proteins, Steve Scheiner; Journal of Physical Chemistry B

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Hydrogen Bonding of Radicals: Interaction of Dimethyl Ether with OOH, HOOH and OOH-, M. Solimannejad and Steve Scheiner; Chemical Physics Letters

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Stabilities and Properties of Complexes Pairing Hydroperoxyl Radical with Monohalomethanes, M. Solimannejad and Steve Scheiner; Journal of Physical Chemistry A

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Weak Hydrogen Bonds in Complexes Pairing Monohalomethanes with Neutral Formic Acid, M. Solimannejad and Steve Scheiner; Chemical Physics Letters

Thermodynamic Origin of the Increased Rate of Hydrolysis of Phosphate and Phosphorothioate Esters in DMSO/Water Mixtures, K. Sorensen-Stowell and Alvan C. Hengge; Journal of Organic Chemistry

2005

Mechanistic Studies on Enzyme-Catalyzed Phosphoryl Transfer, Alvan C. Hengge; Advances in Physical Organic Chemistry

Secondary Isotope Effects, Alvan C. Hengge; Isotope Effects in Chemistry and Biology

Physical Organic Perspectives on Phospho Group Transfer from Phosphates and Phosphinates, Alvan C. Hengge and I. Onyido; Current Organic Chemistry

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Stepwise Hydration of Ionized Aromatics. Energies and Structures of the Hydrated Benzene Cation, and the Mechanism of Deprotonation Reactions, Yehia M. Ibrahim, Michael Meot-Ner, Edreese H. Alshraeh, M. Samy El-Shall, and Steve Scheiner; Journal of the American Chemical Society

Effects of Peripheral Substituents on the Electronic Structure and Properties of Unligated and Ligated Metal Phthalocyanines, Metal = Fe, Co, Zn, M.-S. Liao, J. D. Watts, M.-J. Huang, S. M. Gorun, T. Kar, and Steve Scheiner; Journal of Chemical Theory and Computation

A Concerted Mechanism for the Transfer of the Thiophosphinoyl Group from Aryl Dimethylphosphinothioate Esters to Oxyanionic Nucleophiles in Aqueous Solution, I. Onyido, K. Swierczek, J. Purcell, and Alvan C. Hengge; Journal of the American Chemical Society

The Thermodynamics of Phosphate versus Phosphorothioate Ester Hydrolysis, J. Purcell and Alvan C. Hengge; Journal of Organic Chemistry

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Relative Strengths of NH··O and CH··O Hydrogen Bonds between Polypeptide Chain Segments, Steve Scheiner; Journal of Physical Chemistry B

The CH··O Hydrogen Bond. A Historical Account, Steve Scheiner

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Effect of Solvent upon CH···O Hydrogen Bonds with Implications for Protein Folding, Steve Scheiner and T. Kar; Journal of Physical Chemistry B