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List of works by José A.N.F. Gomes

A computational analysis of the insertion of carbon nanotubes into cellular membranes

article

Aromaticity and ring currents.

scientific article

Comparative analysis of the performance of commonly available density functionals in the determination of geometrical parameters for zinc complexes

article

Comparative density functional theory study on thiacalix[4]arene binding modes for Zn2+ and Cu2+

scientific article published on 01 December 2005

Contribution of unusual arginine-arginine short-range interactions to stabilization and recognition in proteins

scientific article published on 01 February 1994

Microscopic detail provided for the adsorption of protected amino-cyclopentene on Si(100)

Molecular dynamics simulation of the water/1,2-dichloroethane interface

article

New parameterization scheme of DFT-D for graphitic materials.

scientific article published on 25 March 2013

Parallel implementation of a Monte Carlo molecular stimulation program

scientific article

QM/QM study of the coverage effects on the adsorption of amino-cyclopentene at the Si(100) surface

scientific article published on 01 November 2006

Some Comments on Topological Approaches to the π-Electron Currents in Conjugated Systems

scientific article published on 05 October 2011

The search for a new model structure of beta-factor XIIa

scientific article published on 01 April 2001

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