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Ireta, Joel, Neugebauer, Jörg, Scheffler, Matthias, Rojo, Arturo, Galván, Marcelo (2005) Structural Transitions in the Polyalanine α-Helix under Uniaxial Strain. Journal Of The American Chemical Society, 127 (49) 17241-17244 doi:10.1021/ja053538j

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Reference TypeJournal (article/letter/editorial)
TitleStructural Transitions in the Polyalanine α-Helix under Uniaxial Strain
JournalJournal Of The American Chemical Society
AuthorsIreta, JoelAuthor
Neugebauer, JörgAuthor
Scheffler, MatthiasAuthor
Rojo, ArturoAuthor
Galván, MarceloAuthor
Year2005 (December)Volume127
Issue49
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/ja053538jSearch in ResearchGate
Generate Citation Formats
Mindat Ref. ID1661635Long-form Identifiermindat:1:5:1661635:6
GUID0
Full ReferenceIreta, Joel, Neugebauer, Jörg, Scheffler, Matthias, Rojo, Arturo, Galván, Marcelo (2005) Structural Transitions in the Polyalanine α-Helix under Uniaxial Strain. Journal Of The American Chemical Society, 127 (49) 17241-17244 doi:10.1021/ja053538j
Plain TextIreta, Joel, Neugebauer, Jörg, Scheffler, Matthias, Rojo, Arturo, Galván, Marcelo (2005) Structural Transitions in the Polyalanine α-Helix under Uniaxial Strain. Journal Of The American Chemical Society, 127 (49) 17241-17244 doi:10.1021/ja053538j
In(2005, December) Journal Of The American Chemical Society Vol. 127 (49) American Chemical Society (ACS)

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Ireta, Joel, Neugebauer, Jörg, Scheffler, Matthias, Rojo, Arturo, Galván, Marcelo (2003) Density Functional Theory Study of the Cooperativity of Hydrogen Bonds in Finite and Infinite α-Helices. The Journal of Physical Chemistry B, 107 (35). 9616 doi:10.1021/jp035865o
Ireta, Joel, Neugebauer, Jörg, Scheffler, Matthias, Rojo, Arturo, Galván, Marcelo (2003) Density Functional Theory Study of the Cooperativity of Hydrogen Bonds in Finite and Infinite α-Helices. The Journal of Physical Chemistry B, 107 (6). 1432-1437 doi:10.1021/jp026848m
Aparicio, Felipe, Ireta, Joel, Rojo, Arturo, Escobar, Laura, Cedillo, Andrés, Galván, Marcelo (2003) On the Existence of Electronic States Confined by Charged Groups in Proteins. The Journal of Physical Chemistry B, 107 (7). 1692-1697 doi:10.1021/jp021575g
Ireta, Joel, Neugebauer, Jörg, Scheffler, Matthias (2004) On the Accuracy of DFT for Describing Hydrogen Bonds:  Dependence on the Bond Directionality. The Journal of Physical Chemistry A, 108 (26). 5692-5698 doi:10.1021/jp0377073
Ireta, Joel, Galván, Marcelo, Cho, Kyeonjgae, Joannopoulos, John D. (1998) Local Reactivity of Charybdotoxin, a K+Channel Blocker. Journal Of The American Chemical Society, 120 (38) 9771-9778 doi:10.1021/ja973762b
Ismer, Lars, Ireta, Joel, Neugebauer, Jörg (2008) First-Principles Free-Energy Analysis of Helix Stability:  The Origin of the Low Entropy in π Helices. The Journal of Physical Chemistry B, 112 (13). 4109-4112 doi:10.1021/jp077728n
Ismer, Lars, Ireta, Joel, Neugebauer, Jörg (2011) A density functional theory based estimation of the anharmonic contributions to the free energy of a polypeptide helix. The Journal of Chemical Physics, 135 (8). 84122pp. doi:10.1063/1.3629451
Ireta, Joel, Galván, Marcelo (1996) Plane waves basis sets in the description of diatomic anions and valence charge density. The Journal of Chemical Physics, 105 (18). 8231-8236 doi:10.1063/1.472701
Guevara-García, Alfredo, Ireta, Joel, Galván, Marcelo (2015) Sensing polarization effects through the analysis of the effective C6 dispersion coefficients in NaCl solutions. The Journal of Chemical Physics, 142 (1). 14504pp. doi:10.1063/1.4905125
Ireta, Joel, Scheffler, Matthias (2009) Density functional theory study of the conformational space of an infinitely long polypeptide chain. The Journal of Chemical Physics, 131 (8). 85104pp. doi:10.1063/1.3207815
Adasme-Carreño, Francisco, Ochoa-Calle, Alvaro, Galván, Marcelo, Ireta, Joel (2024) Conformational preference of dipeptide zwitterions in aqueous solvents. Physical Chemistry Chemical Physics, 26 (10) 8210-8218 doi:10.1039/d3cp05742a
 
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