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Geoffrey Hutchison
Geoffrey Hutchison
Professor of Chemistry, University of Pittsburgh
Dirección de correo verificada de pitt.edu - Página principal
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Open Babel: An open chemical toolbox
NM O'Boyle, M Banck, CA James, C Morley, T Vandermeersch, ...
Journal of cheminformatics 3, 1-14, 2011
86102011
Avogadro: an advanced semantic chemical editor, visualization, and analysis platform
MD Hanwell, DE Curtis, DC Lonie, T Vandermeersch, E Zurek, ...
Journal of cheminformatics 4, 1-17, 2012
85292012
Hopping transport in conductive heterocyclic oligomers: reorganization energies and substituent effects
GR Hutchison, MA Ratner, TJ Marks
Journal of the American Chemical Society 127 (7), 2339-2350, 2005
7692005
Building Blocks for N-Type Molecular and Polymeric Electronics. Perfluoroalkyl- versus Alkyl-Functionalized Oligothiophenes (nTs; n = 2−6). Systematic Synthesis …
A Facchetti, MH Yoon, CL Stern, GR Hutchison, MA Ratner, TJ Marks
Journal of the American Chemical Society 126 (41), 13480-13501, 2004
7272004
Building Blocks for n-Type Molecular and Polymeric Electronics. Perfluoroalkyl- versus Alkyl-Functionalized Oligothiophenes (nT; n = 2-6). Systematics of Thin Film …
A Facchetti, M Mushrush, MH Yoon, GR Hutchison, MA Ratner, TJ Marks
J. Am. Chem. Soc 126 (42), 13859-13874, 2004
7272004
The Blue Obelisk—interoperability in chemical informatics
R Guha, MT Howard, GR Hutchison, P Murray-Rust, H Rzepa, ...
Journal of chemical information and modeling 46 (3), 991-998, 2006
4952006
Intermolecular charge transfer between heterocyclic oligomers. Effects of heteroatom and molecular packing on hopping transport in organic semiconductors
GR Hutchison, MA Ratner, TJ Marks
Journal of the American Chemical Society 127 (48), 16866-16881, 2005
4802005
Pybel: a Python wrapper for the OpenBabel cheminformatics toolkit
NM O'Boyle, C Morley, GR Hutchison
Chemistry Central Journal 2, 1-7, 2008
4272008
Confab-Systematic generation of diverse low-energy conformers
NM O'Boyle, T Vandermeersch, CJ Flynn, AR Maguire, GR Hutchison
Journal of cheminformatics 3, 1-9, 2011
2732011
Tuning the Kondo effect with a mechanically controllable break junction
JJ Parks, AR Champagne, GR Hutchison, S Flores-Torres, HD Abruna, ...
Physical Review Letters 99 (2), 026601, 2007
2472007
Charge hopping in molecular wires as a sequence of electron-transfer reactions
YA Berlin, GR Hutchison, P Rempala, MA Ratner, J Michl
The Journal of Physical Chemistry A 107 (19), 3970-3980, 2003
2292003
Efficient computational screening of organic polymer photovoltaics
IY Kanal, SG Owens, JS Bechtel, GR Hutchison
The journal of physical chemistry letters 4 (10), 1613-1623, 2013
2062013
Computational design and selection of optimal organic photovoltaic materials
NM O’Boyle, CM Campbell, GR Hutchison
The Journal of Physical Chemistry C 115 (32), 16200-16210, 2011
1932011
Electronic structure of conducting polymers: Limitations of oligomer extrapolation approximations and effects of heteroatoms
GR Hutchison, YJ Zhao, B Delley, AJ Freeman, MA Ratner, TJ Marks
Physical Review B 68 (3), 035204, 2003
1902003
Accurate prediction of band gaps in neutral heterocyclic conjugated polymers
GR Hutchison, MA Ratner, TJ Marks
The Journal of Physical Chemistry A 106 (44), 10596-10605, 2002
1512002
Avogadro: an advanced semantic chemical editor, visualization, and analysis platform. J Cheminform 4: 17
MD Hanwell, DE Curtis, DC Lonie, T Vandermeersch, E Zurek, ...
1502012
Anode interfacial engineering approaches to enhancing anode/hole transport layer interfacial stability and charge injection efficiency in organic light-emitting diodes
J Cui, Q Huang, JCG Veinot, H Yan, Q Wang, GR Hutchison, AG Richter, ...
Langmuir 18 (25), 9958-9970, 2002
1322002
Open Babel: an open chemical toolbox. J Cheminform. 2011; 3: 33
NM O’Boyle, M Banck, CA James, C Morley, T Vandermeersch, ...
1112021
Open data, open source and open standards in chemistry: the Blue Obelisk five years on
NM O'boyle, R Guha, EL Willighagen, SE Adams, J Alvarsson, JC Bradley, ...
Journal of cheminformatics 3, 1-15, 2011
972011
Electronic structure and band gaps in cationic heterocyclic oligomers. Multidimensional analysis of the interplay of heteroatoms, substituents, molecular length, and charge on …
GR Hutchison, MA Ratner, TJ Marks
The Journal of Physical Chemistry B 109 (8), 3126-3138, 2005
942005
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Artículos 1–20