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Welcome | Gascon Lab Research Group at UCONN

Skip to main content. Gascon Lab Research Group at UCONN. QM/MM Treatment of Protein Active Sites. Electronic structure calculations are necessary to properly describe protein chromophores and bound ligands. Molecular detail of the photo-isomerization mechanism in the first vision event in rhodopsins. Computational modeling and characterization of monolayer protected gold clusters. Polarization Effects in Protein Electrostatics. J Phys. Chem. Letters. Drupal website by SNP.

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Welcome | Gascon Lab Research Group at UCONN | gascon.chem.uconn.edu Reviews

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Skip to main content. Gascon Lab Research Group at UCONN. QM/MM Treatment of Protein Active Sites. Electronic structure calculations are necessary to properly describe protein chromophores and bound ligands. Molecular detail of the photo-isomerization mechanism in the first vision event in rhodopsins. Computational modeling and characterization of monolayer protected gold clusters. Polarization Effects in Protein Electrostatics. J Phys. Chem. Letters. Drupal website by SNP.

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2 publications

3 people

4 software

5 links

6 vision proteins

7 gold nanoclusters

8 welcome

9 spotlight publication

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Welcome | Gascon Lab Research Group at UCONN | gascon.chem.uconn.edu Reviews

https://gascon.chem.uconn.edu

Skip to main content. Gascon Lab Research Group at UCONN. QM/MM Treatment of Protein Active Sites. Electronic structure calculations are necessary to properly describe protein chromophores and bound ligands. Molecular detail of the photo-isomerization mechanism in the first vision event in rhodopsins. Computational modeling and characterization of monolayer protected gold clusters. Polarization Effects in Protein Electrostatics. J Phys. Chem. Letters. Drupal website by SNP.

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People | Gascon Lab Research Group at UCONN

http://gascon.chem.uconn.edu/people

Skip to main content. Gascon Lab Research Group at UCONN. Jose A. Gascon. Postdoctoral Associate, Yale University, 2002-2006. PhD Louisiana State University, 1998-2002. Licenciado in Physics, Universidad Nacional de Córdoba, Argentina, 1991-1996. In 2012, he was promoted to Associate Professor. His current research is centered in understanding structural and dynamical properties of biomolecules and biomaterials. Email: svetlana.gelpi at uconn.edu. Email: alissa.richard at gmail.com. Drupal website by SNP.

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Software | Gascon Lab Research Group at UCONN

http://gascon.chem.uconn.edu/software

Skip to main content. Gascon Lab Research Group at UCONN. The implementation details of the method are found in following papers:. 1) Gascón, J. A. Leung, S. S. F. Batista, E. R. Batista, V. S. Journal of Chemical Theory and Computation. 2006, 2, 175-186. 2) Menikarachchi, L. C. Gascón, J. A. Journal of Molecular Modeling. 2008, 14, 479-487. Development of MODQ3M is partially supported by a grant from the National Science Fundation. ModQ3Mtools.tar .gz. Drupal website by SNP.

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Publications | Gascon Lab Research Group at UCONN

http://gascon.chem.uconn.edu/publications

Skip to main content. Gascon Lab Research Group at UCONN. Fullerene-Assisted Photoinduced Charge Transfer of Single-Walled Carbon Nanotubes through a Flavin Helix. Mehdi Mollahosseini, Erandika Karunaratne, George N. Gibson, Jose A. Gascón, and Fotios Papadimitrakopoulos. J Am Chem. Soc. Michael A. Hyland, Nisansala Hewage, Kimberly Panther, Arunpatcha Nimthong-Roldán, Matthias Zeller, Milinda Samaraweera, José A. Gascon, and Christian Brückner. J Phys. Chem. C. J Chem. Theor. Comput. Milinda Samaraweera...

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Welcome | Gascon Lab Research Group at UCONN

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Skip to main content. Gascon Lab Research Group at UCONN. QM/MM Treatment of Protein Active Sites. Electronic structure calculations are necessary to properly describe protein chromophores and bound ligands. Molecular detail of the photo-isomerization mechanism in the first vision event in rhodopsins. Computational modeling and characterization of monolayer protected gold clusters. Polarization Effects in Protein Electrostatics. Connectivity-Based Biocompatible Force Field for Thiolated Gold Nanoclusters.

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Links | Gascon Lab Research Group at UCONN

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Skip to main content. Gascon Lab Research Group at UCONN. University of Connecticut Department of Chemistry. Drupal website by SNP.

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Collaborators | The Brückner Research Group

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Skip to UConn Search. The Brückner Research Group. Search in http:/ bruckner.research.uconn.edu/. The Brückner Research Group. Laboratories and Chemistry Building. Research Papers and Reviews. Search in http:/ bruckner.research.uconn.edu/. Development of dye-sensitized solar cells: Alex Agrios. Dept of Environmental Engineering and Center for Clean Energy Engineering). Development of explosives sensors: Yu Lei. Dept of Chemical and Biomolecular. Photoacoustic tissue imaging: Quing Zhu. Institute of Inorg...

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Welcome | Gascon Lab Research Group at UCONN

Skip to main content. Gascon Lab Research Group at UCONN. QM/MM Treatment of Protein Active Sites. Electronic structure calculations are necessary to properly describe protein chromophores and bound ligands. Molecular detail of the photo-isomerization mechanism in the first vision event in rhodopsins. Computational modeling and characterization of monolayer protected gold clusters. Polarization Effects in Protein Electrostatics. J Phys. Chem. Letters. Drupal website by SNP.

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