BioSimGrid: towards a worldwide repository for biomolecular simulations
Tai, Kaihsu, Murdock, Stuart, Wu, Bing, Ng, Muan Hong, Johnston, Steven, Fangohr, Hans, Cox, Simon J., Jeffreys, Paul, Essex, Jonathan W. and Sansom, Mark S.P. (2004) BioSimGrid: towards a worldwide repository for biomolecular simulations. Organic & Biomolecular Chemistry, 2, (22), 3219-3221. (doi:10.1039/b411352g)
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Official URL: http://dx.doi.org/10.1039/b411352g
Description/Abstract
BioSimGrid is a database for biomolecular simulations, or, a 'Protein Data Bank extended in time' for molecular dynamics trajectories. We describe the implementation details: architecture, data schema, deposition, and analysis modules. We encourage the simulation community to explore BioSimGrid and work towards a common trajectory exchange format.
| Item Type: | Article |
|---|---|
| ISSN: | 1477-0520 (print) |
| Related URLs: | http://www.ncbi.nlm.nih.gov/en...med_docsum http://dx.doi.org/10.1039/b411352g |
| Subjects: | Q Science > QD Chemistry T Technology > TA Engineering (General). Civil engineering (General) Q Science > QA Mathematics > QA76 Computer software |
| Divisions: | University Structure - Pre August 2011 > School of Engineering Sciences University Structure - Pre August 2011 > School of Chemistry |
| ePrint ID: | 22974 |
| URI: | http://eprints.soton.ac.uk/id/eprint/22974 |
| Deposited On: | 23 Mar 2006 |
| Last Modified: | 01 Apr 2012 02:42 |
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