e-NMR gLite grid enabled infrastructure
Ferreira, N.L.; Wassenaar, T.A.; de Vries, S.J.; van Dijk, M.; van der Schot, G.; van der Zwan, J.; Boelens, R.; Bonvin, A.M.J.J.; Giachetti, A.; Carotenuto, D.; Rosato, A.; Bertini, I.; Herrmann, T.; Bagaria, A.; Zharavin, V.; Jonker, H.R.A.; Güntert, P.; Schwalbe, H.; Vranken, W.F.
(2010) Proença, A., Pina, A., García Tobío, J., Ribeiro, L. (eds.), Ibergrid 2010 : 4th Iberian Grid Infrastructure Conference (May 2010, Braga, Portugal), pp. 360 - 380
Computacion, pp. 360 - 380
IBERGRID'2010 - 4th Iberian Grid Infrastructure Conference (May 2010, Braga, Portugal), pp. 360 - 380
(Part of book)
Abstract
The e-NMR project is an European e-infrastructure that aims at providing the bio-NMR community with a software platform integrating and streamlining computational approaches necessary for NMR data analysis. The infrastructure is grid enabled with fteen gLite based partners sharing computational resources. A main focus of the consortium is to provide
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protocoled services through easy-to-use web interfaces, while retaining su cient exibility to handle speci c requests by expert users. Various programs relevant for structural biology scientists are grid ported and already available through the e-NMR web portal, including HADDOCK, XPLORNIH, CYANA and CS-ROSETTA among others. A general overview of the project current status toward EGEE/EGI integration, as well as brief guidelines on how to become an e-NMR site/user will be considered. With more than 170 registered users, enmr.eu is currently the second largest virtual organization in the life sciences. The state of the project can be found on the web page http://www.enmr.eu.
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Embargo until January 01 2050
ISBN: 978-84-9745-549-7
Publisher: Netbiblo
Note: IBERGRID'2010 - 4th Iberian Grid Infrastructure Conference (May 2010, Braga, Portugal)
(Peer reviewed)