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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 103, 2005 - Issue 11-12: A Special Issue in Honour of Professor John P. Simons-Part I
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Original Articles

A computational and spectroscopic study of the gas-phase conformers of adrenaline

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Pages 1633-1639 | Received 15 Sep 2004, Accepted 16 Dec 2004, Published online: 21 Feb 2007

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N. P. Yadav, A. K. Vishwkarma, K. Kumar, A. Vats, A. Pathak, R. Kumar, V. Mukerjee, S. Moharana, T. Yadav, C. Mahapatra & S. Srivastava. (2022) Theoretical spectroscopic signature of synephrine using DFT and the effect of hydrogen removal. Phase Transitions 95:7, pages 475-485.
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N. A. Macleod & J. P. Simons. (2007) Infrared photodissociation spectroscopy of protonated neurotransmitters in the gas phase. Molecular Physics 105:5-7, pages 689-700.
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N. A. Macleod & J. P. Simons. (2006) Infrared photodissociation spectroscopy of protonated neurotransmitters in the gas phase – ARTICLE WITHDRAWN. Molecular Physics 104:20-21, pages 3317-3328.
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Dimitrios Toroz & Tanja van Mourik. (2006) The structure of the gas-phase tyrosine–glycine dipeptide. Molecular Physics 104:4, pages 559-570.
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Thomas F. Miller III & David C. Clary. (2005) Torsional anharmonicity in the conformational thermodynamics of flexible molecules. Molecular Physics 103:11-12, pages 1573-1578.
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Ling Pei. (2023) Weak Interactions between Epinephrine and Thymine. Letters in Organic Chemistry 20:3, pages 230-238.
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Keisuke Yamaguchi, Keisuke Hirata, Shun-ichi Ishiuchi & Masaaki Fujii. (2022) Ultraviolet and infrared spectra of mono-, di- and tri-hydrated clusters of protonated noradrenaline – Solvation and conformational variations. Chemical Physics Letters 806, pages 140014.
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Miguel Sanz-Novo, Iker León, Elena R. Alonso & José L. Alonso. (2022) Unleashing the shape of l -DOPA at last . Physical Chemistry Chemical Physics 24:6, pages 3546-3554.
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Amr Mohamed, Asmaa M. Fahim, Samah Abd Elhamead Ibrahim & Medhat A. Ibrahim. (2021) Studies on hydrogen bonding of adrenaline/acetone and adrenaline/methanol complexes: computational and experimental approach. Structural Chemistry 32:6, pages 2115-2138.
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E P Altova, A N Rykov & I F Shishkov. (2021) Study of bioactive molecular systems by gas-phase electron diffraction: examples, limitations and possibilities. Journal of Physics: Conference Series 2091:1, pages 012025.
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Keisuke Hirata, Ken-ichi Kasai, Gilles Grégoire, Shun-ichi Ishiuchi & Masaaki Fujii. (2021) Hydration-controlled excited-state relaxation in protonated dopamine studied by cryogenic ion spectroscopy. The Journal of Chemical Physics 155:15.
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Amr Mohamed, Asmaa M. Fahim & Medhat A. Ibrahim. (2020) Theoretical investigation on hydrogen bond interaction between adrenaline and hydrogen sulfide. Journal of Molecular Modeling 26:12.
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Jordan Dezalay, Michel Broquier, Satchin Soorkia, Keisuke Hirata, Shun-ichi Ishiuchi, Masaaki Fujii & Gilles Grégoire. (2020) Excited-state proton transfer in protonated adrenaline revealed by cryogenic UV photodissociation spectroscopy. Physical Chemistry Chemical Physics 22:20, pages 11498-11507.
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T. Yadav & V. Mukherjee. (2020) Optimization of synephrine and its vibrational and electronic structures. Vibrational Spectroscopy 106, pages 102989.
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JEAN-PIERRE SCHERMANN. 2008. Spectroscopy and Modeling of Biomolecular Building Blocks. Spectroscopy and Modeling of Biomolecular Building Blocks 309 321 .
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Christopher M. Baker & Guy H. Grant. (2007) The Effect of Solvation on Biomolecular Conformation:  2-Amino-1-phenylethanol. The Journal of Physical Chemistry B 111:33, pages 9940-9954.
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