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Coherent exciton-vibrational dynamics and energy transfer in conjugated organics.
Nelson TR, Ondarse-Alvarez D, Oldani N, Rodriguez-Hernandez B, Alfonso-Hernandez L, Galindo JF, Kleiman VD, Fernandez-Alberti S, Roitberg AE, Tretiak S. Nelson TR, et al. Among authors: roitberg ae. Nat Commun. 2018 Jun 13;9(1):2316. doi: 10.1038/s41467-018-04694-8. Nat Commun. 2018. PMID: 29899334 Free PMC article.
A versatile AMBER-Gaussian QM/MM interface through PUPIL.
Torras J, Seabra Gde M, Deumens E, Trickey SB, Roitberg AE. Torras J, et al. Among authors: roitberg ae. J Comput Chem. 2008 Jul 30;29(10):1564-73. doi: 10.1002/jcc.20915. J Comput Chem. 2008. PMID: 18270957
Molecular and functional characterization of a juvenile hormone acid methyltransferase expressed in the corpora allata of mosquitoes.
Mayoral JG, Nouzova M, Yoshiyama M, Shinoda T, Hernandez-Martinez S, Dolghih E, Turjanski AG, Roitberg AE, Priestap H, Perez M, Mackenzie L, Li Y, Noriega FG. Mayoral JG, et al. Among authors: roitberg ae. Insect Biochem Mol Biol. 2009 Jan;39(1):31-7. doi: 10.1016/j.ibmb.2008.09.010. Epub 2008 Oct 17. Insect Biochem Mol Biol. 2009. PMID: 18984053 Free PMC article.
143 results