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A fault tolerant workflow for CPU demanding calculations

Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics) (2011) 6784 LNCS(PART 3) 387-396
DOI: 10.1007/978-3-642-21931-3_30
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Abstract

In the paper the application porting process developed for the DL-POLY package, using the P-GRADE Grid Portal tool available in COMPCHEM, is described. For this purpose a new workflow stategy to perform long run calculations has been designed and a set of visualization tools has been implemented. © 2011 Springer-Verlag.

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Costantini, A., Gervasi, O., & Laganà, A. (2011). A fault tolerant workflow for CPU demanding calculations. In Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics) (Vol. 6784 LNCS, pp. 387–396). https://doi.org/10.1007/978-3-642-21931-3_30

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