| Year |
Citation |
Score |
| 2020 |
Shemesh D, Luo M, Grassian VH, Gerber RB. Absorption spectra of pyruvic acid in water: insights from calculations for small hydrates and comparison to experiment. Physical Chemistry Chemical Physics : Pccp. PMID 32458893 DOI: 10.1039/D0Cp01810D |
0.639 |
|
| 2020 |
Luo M, Shemesh D, Sullivan MN, Alves MR, Song M, Gerber RB, Grassian VH. The Impact of pH and NaCl and CaCl Salts on the Speciation and Photochemistry of Pyruvic Acid in the Aqueous Phase. The Journal of Physical Chemistry. A. PMID 32441097 DOI: 10.1021/Acs.Jpca.0C01016 |
0.575 |
|
| 2018 |
Shemesh D, Gerber RB. Molecular Dynamics of Photoinduced Reactions of Acrylic Acid: Products, Mechanisms and Comparison with Experiment. The Journal of Physical Chemistry Letters. PMID 29325414 DOI: 10.1021/Acs.Jpclett.7B03015 |
0.685 |
|
| 2018 |
Shemesh D, Salomon R, Kim SH, Tyndall GS, Nizkorodov SA, Gerber RB. Adjacent keto and enol groups in photochemistry of a cyclic molecule: Products, mechanisms and dynamics Chemical Physics. 515: 177-186. DOI: 10.1016/J.Chemphys.2018.07.045 |
0.664 |
|
| 2017 |
Naoum JN, Chandra K, Shemesh D, Gerber RB, Gilon C, Hurevich M. DMAP-assisted sulfonylation as an efficient step for the methylation of primary amine motifs on solid support. Beilstein Journal of Organic Chemistry. 13: 806-816. PMID 28546838 DOI: 10.3762/Bjoc.13.81 |
0.582 |
|
| 2017 |
Aregahegn KZ, Shemesh D, Gerber RB, Finlayson-Pitts BJ. Photochemistry of Thin Solid Films of the Neonicotinoid Imidacloprid on Surfaces. Environmental Science & Technology. 51: 2660-2668. PMID 27989110 DOI: 10.1021/Acs.Est.6B04842 |
0.607 |
|
| 2016 |
Shemesh D, Nizkorodov SA, Gerber RB. Photochemical Reactions of Cyclohexanone: Mechanisms and Dynamics. The Journal of Physical Chemistry. A. 120: 7112-20. PMID 27525541 DOI: 10.1021/Acs.Jpca.6B06184 |
0.642 |
|
| 2015 |
Gerber RB, Varner ME, Hammerich AD, Riikonen S, Murdachaew G, Shemesh D, Finlayson-Pitts BJ. Computational studies of atmospherically-relevant chemical reactions in water clusters and on liquid water and ice surfaces. Accounts of Chemical Research. 48: 399-406. PMID 25647299 DOI: 10.1021/Ar500431G |
0.681 |
|
| 2015 |
Romonosky DE, Nguyen LQ, Shemesh D, Nguyen TB, Epstein SA, Martin DBC, Vanderwal CD, Gerber RB, Nizkorodov SA. Absorption spectra and aqueous photochemistry of β-hydroxyalkyl nitrates of atmospheric interest Molecular Physics. DOI: 10.1080/00268976.2015.1017020 |
0.586 |
|
| 2014 |
Shemesh D, Blair SL, Nizkorodov SA, Gerber RB. Photochemistry of aldehyde clusters: cross-molecular versus unimolecular reaction dynamics. Physical Chemistry Chemical Physics : Pccp. 16: 23861-8. PMID 25273824 DOI: 10.1039/C4Cp03130J |
0.663 |
|
| 2014 |
Gerber RB, Shemesh D, Varner ME, Kalinowski J, Hirshberg B. Ab initio and semi-empirical Molecular Dynamics simulations of chemical reactions in isolated molecules and in clusters. Physical Chemistry Chemical Physics : Pccp. 16: 9760-75. PMID 24569494 DOI: 10.1039/C3Cp55239J |
0.729 |
|
| 2013 |
Lignell H, Epstein SA, Marvin MR, Shemesh D, Gerber B, Nizkorodov S. Experimental and theoretical study of aqueous cis-pinonic acid photolysis. The Journal of Physical Chemistry. A. 117: 12930-45. PMID 24245507 DOI: 10.1021/Jp4093018 |
0.417 |
|
| 2013 |
Shemesh D, Lan Z, Gerber RB. Dynamics of triplet-state photochemistry of pentanal: mechanisms of Norrish I, Norrish II, and H abstraction reactions. The Journal of Physical Chemistry. A. 117: 11711-24. PMID 23772671 DOI: 10.1021/Jp401309B |
0.694 |
|
| 2012 |
Epstein SA, Shemesh D, Tran VT, Nizkorodov SA, Gerber RB. Absorption spectra and photolysis of methyl peroxide in liquid and frozen water. The Journal of Physical Chemistry. A. 116: 6068-77. PMID 22217262 DOI: 10.1021/Jp211304V |
0.579 |
|
| 2012 |
Shemesh D, Gerber RB. Femtosecond timescale deactivation of electronically excited peroxides at ice surfaces Molecular Physics. 110: 605-617. DOI: 10.1080/00268976.2012.666279 |
0.62 |
|
| 2011 |
Shemesh D, Domcke W. Effect of the chirality of residues and γ-turns on the electronic excitation spectra, excited-state reaction paths and conical intersections of capped phenylalanine-alanine dipeptides Chemphyschem. 12: 1833-1840. PMID 21488142 DOI: 10.1002/Cphc.201100039 |
0.589 |
|
| 2010 |
Shemesh D, Sobolewski AL, Domcke W. Role of excited-state hydrogen detachment and hydrogen-transfer processes for the excited-state deactivation of an aromatic dipeptide: N-acetyl tryptophan methyl amide Physical Chemistry Chemical Physics. 12: 4899-4905. PMID 20445897 DOI: 10.1039/B927024H |
0.579 |
|
| 2009 |
Shemesh D, Sobolewski AL, Domcke W. Efficient excited-state deactivation of the gly-phe-ala tripeptide via an electron-driven proton-transfer process Journal of the American Chemical Society. 131: 1374-1375. PMID 19140760 DOI: 10.1021/Ja808485B |
0.572 |
|
| 2009 |
Sobolewski AL, Shemesh D, Domcke W. Computational studies of the photophysics of neutral and zwitterionic amino acids in an aqueous environment: Tyrosine-(H2O)2 and tryptophan-(H2O)2 clusters Journal of Physical Chemistry A. 113: 542-550. PMID 19099467 DOI: 10.1021/Jp8091754 |
0.549 |
|
| 2009 |
Shemesh D, Hättig C, Domcke W. Photophysics of the Trp-Gly dipeptide: Role of electron and proton transfer processes for efficient excited-state deactivation Chemical Physics Letters. 482: 38-43. DOI: 10.1007/978-3-642-13872-0_53 |
0.57 |
|
| 2008 |
Shemesh D, Mullin J, Gordon MS, Gerber RB. Vibrational spectroscopy for glycine adsorbed on silicon clusters: Harmonic and anharmonic calculations for models of the Si(1 0 0)-2 × 1 surface Chemical Physics. 347: 218-228. DOI: 10.1016/J.Chemphys.2007.09.062 |
0.604 |
|
| 2006 |
Shemesh D, Gerber RB. Classical trajectory simulations of photoionization dynamics of tryptophan: intramolecular energy flow, hydrogen-transfer processes and conformational transitions. The Journal of Physical Chemistry. A. 110: 8401-8. PMID 16821822 DOI: 10.1021/Jp0570869 |
0.677 |
|
| 2005 |
Shemesh D, Gerber RB. Different chemical dynamics for different conformers of biological molecules: photoionization of glycine. The Journal of Chemical Physics. 122: 241104. PMID 16035739 DOI: 10.1063/1.1937407 |
0.65 |
|
| 2005 |
Shemesh D, Baer R, Seideman T, Gerber RB. Photoionization dynamics of glycine adsorbed on a silicon cluster: "on-the-fly" simulations. The Journal of Chemical Physics. 122: 184704. PMID 15918744 DOI: 10.1063/1.1894052 |
0.653 |
|
| 2004 |
Shemesh D, Chaban GM, Gerber RB. Photoionization Dynamics of Glycine: The First 10 Picoseconds The Journal of Physical Chemistry A. 108: 11477-11484. DOI: 10.1021/Jp040331O |
0.662 |
|
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