The paper describes the application porting process onto the EGEE grid of GROMACS package that was carried out using the P-GRADE Grid Portal tool implemented in COMPCHEM. For this purpose a new stategy to access local and distributed resources has been designed and a set of visualization tools has been implemented in order to help chemical insight.
Porting of GROMACS package into the Grid Environment: testing of a new distribution strategy
GERVASI, Osvaldo;LAGANA', Antonio
2010
Abstract
The paper describes the application porting process onto the EGEE grid of GROMACS package that was carried out using the P-GRADE Grid Portal tool implemented in COMPCHEM. For this purpose a new stategy to access local and distributed resources has been designed and a set of visualization tools has been implemented in order to help chemical insight.File in questo prodotto:
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