J. Pytliński, Ł. Skorwider, K. Benedyczak, M. Wroński, P. Bała, and V. Huber
Uniform Access to the Distributed Resources for the Computational Chemistry Using UNICORE
Computational Science - ICCS 2003
International Conference Melbourne, Australia and St. Petersburg, Russia, June 2-4, 2003. Proceedings, Part II
(Lecture Notes in Computer Science 2658)
Eds. P. M. A. Sloot, D. Abramson, A. V. Bogdanov, J. J. Dongarra, A. Y. Zomaya, Y. E. Gorbachev
Springer-Verlag 2003 pp. 307-315
In this paper we describe deployment of quantum chemical and biomolecular
applications on the grid. We have used UNICORE infrastructure as framework
for development dedicated user interface to the number of existing
computational chemistry codes as well as molecular biology databases.
The user interface is integrated with the UNICORE client based on
plugin mechanism which provides general grid functionality
such as single login, job submission and control mechanism.
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