[{"language":[{"iso":"eng"}],"keyword":["General Physics and Astronomy","General Biochemistry","Genetics and Molecular Biology","General Chemistry"],"article_number":"8318","department":[{"_id":"304"}],"user_id":"14931","_id":"34310","status":"public","publication":"Nature Communications","type":"journal_article","doi":"10.1038/ncomms9318","title":"Covalency of hydrogen bonds in liquid water can be probed by proton nuclear magnetic resonance experiments","volume":6,"date_created":"2022-12-09T12:16:04Z","author":[{"orcid":"0000-0002-4945-1481","last_name":"Elgabarty","full_name":"Elgabarty, Hossam","id":"60250","first_name":"Hossam"},{"first_name":"Rustam Z.","full_name":"Khaliullin, Rustam Z.","last_name":"Khaliullin"},{"first_name":"Thomas D.","full_name":"Kühne, Thomas D.","id":"49079","last_name":"Kühne"}],"date_updated":"2023-06-26T07:56:31Z","publisher":"Springer Science and Business Media LLC","intvolume":"         6","citation":{"chicago":"Elgabarty, Hossam, Rustam Z. Khaliullin, and Thomas D. Kühne. “Covalency of Hydrogen Bonds in Liquid Water Can Be Probed by Proton Nuclear Magnetic Resonance Experiments.” <i>Nature Communications</i> 6, no. 1 (2015). <a href=\"https://doi.org/10.1038/ncomms9318\">https://doi.org/10.1038/ncomms9318</a>.","ieee":"H. Elgabarty, R. Z. Khaliullin, and T. D. Kühne, “Covalency of hydrogen bonds in liquid water can be probed by proton nuclear magnetic resonance experiments,” <i>Nature Communications</i>, vol. 6, no. 1, Art. no. 8318, 2015, doi: <a href=\"https://doi.org/10.1038/ncomms9318\">10.1038/ncomms9318</a>.","ama":"Elgabarty H, Khaliullin RZ, Kühne TD. Covalency of hydrogen bonds in liquid water can be probed by proton nuclear magnetic resonance experiments. <i>Nature Communications</i>. 2015;6(1). doi:<a href=\"https://doi.org/10.1038/ncomms9318\">10.1038/ncomms9318</a>","apa":"Elgabarty, H., Khaliullin, R. Z., &#38; Kühne, T. D. (2015). Covalency of hydrogen bonds in liquid water can be probed by proton nuclear magnetic resonance experiments. <i>Nature Communications</i>, <i>6</i>(1), Article 8318. <a href=\"https://doi.org/10.1038/ncomms9318\">https://doi.org/10.1038/ncomms9318</a>","short":"H. Elgabarty, R.Z. Khaliullin, T.D. Kühne, Nature Communications 6 (2015).","mla":"Elgabarty, Hossam, et al. “Covalency of Hydrogen Bonds in Liquid Water Can Be Probed by Proton Nuclear Magnetic Resonance Experiments.” <i>Nature Communications</i>, vol. 6, no. 1, 8318, Springer Science and Business Media LLC, 2015, doi:<a href=\"https://doi.org/10.1038/ncomms9318\">10.1038/ncomms9318</a>.","bibtex":"@article{Elgabarty_Khaliullin_Kühne_2015, title={Covalency of hydrogen bonds in liquid water can be probed by proton nuclear magnetic resonance experiments}, volume={6}, DOI={<a href=\"https://doi.org/10.1038/ncomms9318\">10.1038/ncomms9318</a>}, number={18318}, journal={Nature Communications}, publisher={Springer Science and Business Media LLC}, author={Elgabarty, Hossam and Khaliullin, Rustam Z. and Kühne, Thomas D.}, year={2015} }"},"year":"2015","issue":"1","publication_identifier":{"issn":["2041-1723"]},"publication_status":"published"},{"publication_identifier":{"issn":["1463-9076","1463-9084"]},"publication_status":"published","issue":"13","year":"2014","page":"6146-6152","intvolume":"        16","citation":{"ieee":"T. Watermann, H. Elgabarty, and D. Sebastiani, “Phycocyanobilin in solution – a solvent triggered molecular switch,” <i>Phys. Chem. Chem. Phys.</i>, vol. 16, no. 13, pp. 6146–6152, 2014, doi: <a href=\"https://doi.org/10.1039/c3cp54307b\">10.1039/c3cp54307b</a>.","chicago":"Watermann, Tobias, Hossam Elgabarty, and Daniel Sebastiani. “Phycocyanobilin in Solution – a Solvent Triggered Molecular Switch.” <i>Phys. Chem. Chem. Phys.</i> 16, no. 13 (2014): 6146–52. <a href=\"https://doi.org/10.1039/c3cp54307b\">https://doi.org/10.1039/c3cp54307b</a>.","ama":"Watermann T, Elgabarty H, Sebastiani D. Phycocyanobilin in solution – a solvent triggered molecular switch. <i>Phys Chem Chem Phys</i>. 2014;16(13):6146-6152. doi:<a href=\"https://doi.org/10.1039/c3cp54307b\">10.1039/c3cp54307b</a>","apa":"Watermann, T., Elgabarty, H., &#38; Sebastiani, D. (2014). Phycocyanobilin in solution – a solvent triggered molecular switch. <i>Phys. Chem. Chem. Phys.</i>, <i>16</i>(13), 6146–6152. <a href=\"https://doi.org/10.1039/c3cp54307b\">https://doi.org/10.1039/c3cp54307b</a>","mla":"Watermann, Tobias, et al. “Phycocyanobilin in Solution – a Solvent Triggered Molecular Switch.” <i>Phys. Chem. Chem. Phys.</i>, vol. 16, no. 13, Royal Society of Chemistry (RSC), 2014, pp. 6146–52, doi:<a href=\"https://doi.org/10.1039/c3cp54307b\">10.1039/c3cp54307b</a>.","bibtex":"@article{Watermann_Elgabarty_Sebastiani_2014, title={Phycocyanobilin in solution – a solvent triggered molecular switch}, volume={16}, DOI={<a href=\"https://doi.org/10.1039/c3cp54307b\">10.1039/c3cp54307b</a>}, number={13}, journal={Phys. Chem. Chem. Phys.}, publisher={Royal Society of Chemistry (RSC)}, author={Watermann, Tobias and Elgabarty, Hossam and Sebastiani, Daniel}, year={2014}, pages={6146–6152} }","short":"T. Watermann, H. Elgabarty, D. Sebastiani, Phys. Chem. Chem. Phys. 16 (2014) 6146–6152."},"date_updated":"2022-12-09T12:16:23Z","publisher":"Royal Society of Chemistry (RSC)","volume":16,"author":[{"last_name":"Watermann","full_name":"Watermann, Tobias","first_name":"Tobias"},{"full_name":"Elgabarty, Hossam","id":"60250","orcid":"0000-0002-4945-1481","last_name":"Elgabarty","first_name":"Hossam"},{"full_name":"Sebastiani, Daniel","last_name":"Sebastiani","first_name":"Daniel"}],"date_created":"2022-12-09T12:16:16Z","title":"Phycocyanobilin in solution – a solvent triggered molecular switch","doi":"10.1039/c3cp54307b","publication":"Phys. Chem. Chem. Phys.","type":"journal_article","abstract":[{"lang":"eng","text":"<p>The chromophore phycocyanobilin changes its spectroscopic behaviour upon solvent change. Our calculations trace this effect back to conformational switching, induced by changes in the hydrogen bonding pattern.</p>"}],"status":"public","_id":"34311","user_id":"60250","keyword":["Physical and Theoretical Chemistry","General Physics and Astronomy"],"language":[{"iso":"eng"}]},{"_id":"34312","user_id":"60250","article_number":"16082","keyword":["Physical and Theoretical Chemistry","General Physics and Astronomy"],"language":[{"iso":"eng"}],"type":"journal_article","publication":"Physical Chemistry Chemical Physics","status":"public","date_updated":"2022-12-09T12:16:34Z","publisher":"Royal Society of Chemistry (RSC)","author":[{"id":"60250","full_name":"Elgabarty, Hossam","last_name":"Elgabarty","orcid":"0000-0002-4945-1481","first_name":"Hossam"},{"first_name":"Milian","last_name":"Wolff","full_name":"Wolff, Milian"},{"last_name":"Glaubitz","full_name":"Glaubitz, Adrian","first_name":"Adrian"},{"full_name":"Hinderberger, Dariush","last_name":"Hinderberger","first_name":"Dariush"},{"first_name":"Daniel","last_name":"Sebastiani","full_name":"Sebastiani, Daniel"}],"date_created":"2022-12-09T12:16:29Z","volume":15,"title":"First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy","doi":"10.1039/c3cp51938d","publication_status":"published","publication_identifier":{"issn":["1463-9076","1463-9084"]},"issue":"38","year":"2013","citation":{"apa":"Elgabarty, H., Wolff, M., Glaubitz, A., Hinderberger, D., &#38; Sebastiani, D. (2013). First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy. <i>Physical Chemistry Chemical Physics</i>, <i>15</i>(38), Article 16082. <a href=\"https://doi.org/10.1039/c3cp51938d\">https://doi.org/10.1039/c3cp51938d</a>","bibtex":"@article{Elgabarty_Wolff_Glaubitz_Hinderberger_Sebastiani_2013, title={First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy}, volume={15}, DOI={<a href=\"https://doi.org/10.1039/c3cp51938d\">10.1039/c3cp51938d</a>}, number={3816082}, journal={Physical Chemistry Chemical Physics}, publisher={Royal Society of Chemistry (RSC)}, author={Elgabarty, Hossam and Wolff, Milian and Glaubitz, Adrian and Hinderberger, Dariush and Sebastiani, Daniel}, year={2013} }","short":"H. Elgabarty, M. Wolff, A. Glaubitz, D. Hinderberger, D. Sebastiani, Physical Chemistry Chemical Physics 15 (2013).","mla":"Elgabarty, Hossam, et al. “First Principles Calculation of Inhomogeneous Broadening in Solid-State Cw-EPR Spectroscopy.” <i>Physical Chemistry Chemical Physics</i>, vol. 15, no. 38, 16082, Royal Society of Chemistry (RSC), 2013, doi:<a href=\"https://doi.org/10.1039/c3cp51938d\">10.1039/c3cp51938d</a>.","ama":"Elgabarty H, Wolff M, Glaubitz A, Hinderberger D, Sebastiani D. First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy. <i>Physical Chemistry Chemical Physics</i>. 2013;15(38). doi:<a href=\"https://doi.org/10.1039/c3cp51938d\">10.1039/c3cp51938d</a>","ieee":"H. Elgabarty, M. Wolff, A. Glaubitz, D. Hinderberger, and D. Sebastiani, “First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy,” <i>Physical Chemistry Chemical Physics</i>, vol. 15, no. 38, Art. no. 16082, 2013, doi: <a href=\"https://doi.org/10.1039/c3cp51938d\">10.1039/c3cp51938d</a>.","chicago":"Elgabarty, Hossam, Milian Wolff, Adrian Glaubitz, Dariush Hinderberger, and Daniel Sebastiani. “First Principles Calculation of Inhomogeneous Broadening in Solid-State Cw-EPR Spectroscopy.” <i>Physical Chemistry Chemical Physics</i> 15, no. 38 (2013). <a href=\"https://doi.org/10.1039/c3cp51938d\">https://doi.org/10.1039/c3cp51938d</a>."},"intvolume":"        15"},{"citation":{"ama":"Elgabarty H, Schmieder P, Sebastiani D. Unraveling the existence of dynamic water channels in light-harvesting proteins: alpha-C-phycocyanobilin in vitro. <i>Chem Sci</i>. 2012;4(2):755-763. doi:<a href=\"https://doi.org/10.1039/c2sc21145a\">10.1039/c2sc21145a</a>","ieee":"H. Elgabarty, P. Schmieder, and D. Sebastiani, “Unraveling the existence of dynamic water channels in light-harvesting proteins: alpha-C-phycocyanobilin in vitro,” <i>Chem. Sci.</i>, vol. 4, no. 2, pp. 755–763, 2012, doi: <a href=\"https://doi.org/10.1039/c2sc21145a\">10.1039/c2sc21145a</a>.","chicago":"Elgabarty, Hossam, Peter Schmieder, and Daniel Sebastiani. “Unraveling the Existence of Dynamic Water Channels in Light-Harvesting Proteins: Alpha-C-Phycocyanobilin in Vitro.” <i>Chem. Sci.</i> 4, no. 2 (2012): 755–63. <a href=\"https://doi.org/10.1039/c2sc21145a\">https://doi.org/10.1039/c2sc21145a</a>.","apa":"Elgabarty, H., Schmieder, P., &#38; Sebastiani, D. (2012). Unraveling the existence of dynamic water channels in light-harvesting proteins: alpha-C-phycocyanobilin in vitro. <i>Chem. Sci.</i>, <i>4</i>(2), 755–763. <a href=\"https://doi.org/10.1039/c2sc21145a\">https://doi.org/10.1039/c2sc21145a</a>","short":"H. Elgabarty, P. Schmieder, D. Sebastiani, Chem. Sci. 4 (2012) 755–763.","mla":"Elgabarty, Hossam, et al. “Unraveling the Existence of Dynamic Water Channels in Light-Harvesting Proteins: Alpha-C-Phycocyanobilin in Vitro.” <i>Chem. Sci.</i>, vol. 4, no. 2, Royal Society of Chemistry (RSC), 2012, pp. 755–63, doi:<a href=\"https://doi.org/10.1039/c2sc21145a\">10.1039/c2sc21145a</a>.","bibtex":"@article{Elgabarty_Schmieder_Sebastiani_2012, title={Unraveling the existence of dynamic water channels in light-harvesting proteins: alpha-C-phycocyanobilin in vitro}, volume={4}, DOI={<a href=\"https://doi.org/10.1039/c2sc21145a\">10.1039/c2sc21145a</a>}, number={2}, journal={Chem. Sci.}, publisher={Royal Society of Chemistry (RSC)}, author={Elgabarty, Hossam and Schmieder, Peter and Sebastiani, Daniel}, year={2012}, pages={755–763} }"},"page":"755-763","intvolume":"         4","year":"2012","issue":"2","publication_status":"published","publication_identifier":{"issn":["2041-6520","2041-6539"]},"doi":"10.1039/c2sc21145a","title":"Unraveling the existence of dynamic water channels in light-harvesting proteins: alpha-C-phycocyanobilin in vitro","author":[{"full_name":"Elgabarty, Hossam","id":"60250","last_name":"Elgabarty","orcid":"0000-0002-4945-1481","first_name":"Hossam"},{"full_name":"Schmieder, Peter","last_name":"Schmieder","first_name":"Peter"},{"first_name":"Daniel","last_name":"Sebastiani","full_name":"Sebastiani, Daniel"}],"date_created":"2022-12-09T12:16:40Z","volume":4,"date_updated":"2022-12-09T12:16:47Z","publisher":"Royal Society of Chemistry (RSC)","status":"public","type":"journal_article","publication":"Chem. 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Solvation of Small Disulfonate Anions in Water/Methanol Mixtures Characterized by High-Field Pulse Electron Nuclear Double Resonance and Molecular Dynamics Simulations. <i>The Journal of Physical Chemistry B</i>, <i>114</i>(22), 7429–7438. <a href=\"https://doi.org/10.1021/jp910335t\">https://doi.org/10.1021/jp910335t</a>","bibtex":"@article{Heller_Elgabarty_Zhuang_Sebastiani_Hinderberger_2010, title={Solvation of Small Disulfonate Anions in Water/Methanol Mixtures Characterized by High-Field Pulse Electron Nuclear Double Resonance and Molecular Dynamics Simulations}, volume={114}, DOI={<a href=\"https://doi.org/10.1021/jp910335t\">10.1021/jp910335t</a>}, number={22}, journal={The Journal of Physical Chemistry B}, publisher={American Chemical Society (ACS)}, author={Heller, Jeannine and Elgabarty, Hossam and Zhuang, Bilin and Sebastiani, Daniel and Hinderberger, Dariush}, year={2010}, pages={7429–7438} }","short":"J. Heller, H. Elgabarty, B. Zhuang, D. Sebastiani, D. Hinderberger, The Journal of Physical Chemistry B 114 (2010) 7429–7438.","mla":"Heller, Jeannine, et al. “Solvation of Small Disulfonate Anions in Water/Methanol Mixtures Characterized by High-Field Pulse Electron Nuclear Double Resonance and Molecular Dynamics Simulations.” <i>The Journal of Physical Chemistry B</i>, vol. 114, no. 22, American Chemical Society (ACS), 2010, pp. 7429–38, doi:<a href=\"https://doi.org/10.1021/jp910335t\">10.1021/jp910335t</a>.","chicago":"Heller, Jeannine, Hossam Elgabarty, Bilin Zhuang, Daniel Sebastiani, and Dariush Hinderberger. “Solvation of Small Disulfonate Anions in Water/Methanol Mixtures Characterized by High-Field Pulse Electron Nuclear Double Resonance and Molecular Dynamics Simulations.” <i>The Journal of Physical Chemistry B</i> 114, no. 22 (2010): 7429–38. <a href=\"https://doi.org/10.1021/jp910335t\">https://doi.org/10.1021/jp910335t</a>.","ieee":"J. Heller, H. Elgabarty, B. Zhuang, D. Sebastiani, and D. Hinderberger, “Solvation of Small Disulfonate Anions in Water/Methanol Mixtures Characterized by High-Field Pulse Electron Nuclear Double Resonance and Molecular Dynamics Simulations,” <i>The Journal of Physical Chemistry B</i>, vol. 114, no. 22, pp. 7429–7438, 2010, doi: <a href=\"https://doi.org/10.1021/jp910335t\">10.1021/jp910335t</a>.","ama":"Heller J, Elgabarty H, Zhuang B, Sebastiani D, Hinderberger D. Solvation of Small Disulfonate Anions in Water/Methanol Mixtures Characterized by High-Field Pulse Electron Nuclear Double Resonance and Molecular Dynamics Simulations. <i>The Journal of Physical Chemistry B</i>. 2010;114(22):7429-7438. doi:<a href=\"https://doi.org/10.1021/jp910335t\">10.1021/jp910335t</a>"},"publisher":"American Chemical Society (ACS)","date_updated":"2022-12-09T12:17:02Z","volume":114,"date_created":"2022-12-09T12:16:54Z","author":[{"first_name":"Jeannine","full_name":"Heller, Jeannine","last_name":"Heller"},{"first_name":"Hossam","full_name":"Elgabarty, Hossam","id":"60250","orcid":"0000-0002-4945-1481","last_name":"Elgabarty"},{"full_name":"Zhuang, Bilin","last_name":"Zhuang","first_name":"Bilin"},{"full_name":"Sebastiani, Daniel","last_name":"Sebastiani","first_name":"Daniel"},{"first_name":"Dariush","last_name":"Hinderberger","full_name":"Hinderberger, Dariush"}],"title":"Solvation of Small Disulfonate Anions in Water/Methanol Mixtures Characterized by High-Field Pulse Electron Nuclear Double Resonance and Molecular Dynamics Simulations","doi":"10.1021/jp910335t","publication":"The Journal of Physical Chemistry B","type":"journal_article","status":"public","_id":"34314","user_id":"60250","keyword":["Materials Chemistry","Surfaces","Coatings and Films","Physical and Theoretical Chemistry"],"language":[{"iso":"eng"}]},{"status":"public","publication":"Biomarkers","type":"journal_article","keyword":["Health","Toxicology and Mutagenesis","Clinical Biochemistry","Biochemistry"],"language":[{"iso":"eng"}],"_id":"34315","user_id":"60250","year":"2010","page":"746-752","intvolume":"        15","citation":{"chicago":"Gad, Mohamed Z., Sally I. Hassanein, Sahar M. Abdel-Maksoud, Gamal M. Shaban, Khaled Abou-Aisha, and Hossam Elgabarty. “Assessment of Serum Levels of Asymmetric Dimethylarginine, Symmetric Dimethylarginine And&#60;scp&#62;l&#60;/Scp&#62;-Arginine in Coronary Artery Disease.” <i>Biomarkers</i> 15, no. 8 (2010): 746–52. <a href=\"https://doi.org/10.3109/1354750x.2010.519784\">https://doi.org/10.3109/1354750x.2010.519784</a>.","ieee":"M. Z. Gad, S. I. Hassanein, S. M. Abdel-Maksoud, G. M. Shaban, K. Abou-Aisha, and H. Elgabarty, “Assessment of serum levels of asymmetric dimethylarginine, symmetric dimethylarginine and&#60;scp&#62;l&#60;/scp&#62;-arginine in coronary artery disease,” <i>Biomarkers</i>, vol. 15, no. 8, pp. 746–752, 2010, doi: <a href=\"https://doi.org/10.3109/1354750x.2010.519784\">10.3109/1354750x.2010.519784</a>.","ama":"Gad MZ, Hassanein SI, Abdel-Maksoud SM, Shaban GM, Abou-Aisha K, Elgabarty H. Assessment of serum levels of asymmetric dimethylarginine, symmetric dimethylarginine and&#60;scp&#62;l&#60;/scp&#62;-arginine in coronary artery disease. <i>Biomarkers</i>. 2010;15(8):746-752. doi:<a href=\"https://doi.org/10.3109/1354750x.2010.519784\">10.3109/1354750x.2010.519784</a>","apa":"Gad, M. Z., Hassanein, S. I., Abdel-Maksoud, S. M., Shaban, G. M., Abou-Aisha, K., &#38; Elgabarty, H. (2010). Assessment of serum levels of asymmetric dimethylarginine, symmetric dimethylarginine and&#60;scp&#62;l&#60;/scp&#62;-arginine in coronary artery disease. <i>Biomarkers</i>, <i>15</i>(8), 746–752. <a href=\"https://doi.org/10.3109/1354750x.2010.519784\">https://doi.org/10.3109/1354750x.2010.519784</a>","mla":"Gad, Mohamed Z., et al. “Assessment of Serum Levels of Asymmetric Dimethylarginine, Symmetric Dimethylarginine And&#60;scp&#62;l&#60;/Scp&#62;-Arginine in Coronary Artery Disease.” <i>Biomarkers</i>, vol. 15, no. 8, Informa UK Limited, 2010, pp. 746–52, doi:<a href=\"https://doi.org/10.3109/1354750x.2010.519784\">10.3109/1354750x.2010.519784</a>.","short":"M.Z. Gad, S.I. Hassanein, S.M. Abdel-Maksoud, G.M. Shaban, K. Abou-Aisha, H. Elgabarty, Biomarkers 15 (2010) 746–752.","bibtex":"@article{Gad_Hassanein_Abdel-Maksoud_Shaban_Abou-Aisha_Elgabarty_2010, title={Assessment of serum levels of asymmetric dimethylarginine, symmetric dimethylarginine and&#60;scp&#62;l&#60;/scp&#62;-arginine in coronary artery disease}, volume={15}, DOI={<a href=\"https://doi.org/10.3109/1354750x.2010.519784\">10.3109/1354750x.2010.519784</a>}, number={8}, journal={Biomarkers}, publisher={Informa UK Limited}, author={Gad, Mohamed Z. and Hassanein, Sally I. and Abdel-Maksoud, Sahar M. and Shaban, Gamal M. and Abou-Aisha, Khaled and Elgabarty, Hossam}, year={2010}, pages={746–752} }"},"publication_identifier":{"issn":["1354-750X","1366-5804"]},"publication_status":"published","issue":"8","title":"Assessment of serum levels of asymmetric dimethylarginine, symmetric dimethylarginine and<scp>l</scp>-arginine in coronary artery disease","doi":"10.3109/1354750x.2010.519784","publisher":"Informa UK Limited","date_updated":"2022-12-09T12:17:22Z","volume":15,"author":[{"full_name":"Gad, Mohamed Z.","last_name":"Gad","first_name":"Mohamed Z."},{"full_name":"Hassanein, Sally I.","last_name":"Hassanein","first_name":"Sally I."},{"last_name":"Abdel-Maksoud","full_name":"Abdel-Maksoud, Sahar M.","first_name":"Sahar M."},{"first_name":"Gamal M.","full_name":"Shaban, Gamal M.","last_name":"Shaban"},{"first_name":"Khaled","last_name":"Abou-Aisha","full_name":"Abou-Aisha, Khaled"},{"first_name":"Hossam","full_name":"Elgabarty, Hossam","id":"60250","orcid":"0000-0002-4945-1481","last_name":"Elgabarty"}],"date_created":"2022-12-09T12:17:07Z"}]