/tools/MDBenchmark
MDBenchmark
bio-phys/MDBenchmark
summary
MDBenchmark is a tool that facilitates the generation, execution, and analysis of benchmarks for molecular dynamics simulations. It optimizes the use of computing resources by allowing users to compare performance across different simulation setups and visualize the results.
description
Quickly generate, start and analyze benchmarks for molecular dynamics simulations.
topics
benchmarkmolecular-dynamicssimulationgromacsclinamdhigh-performance-computingpythoncomputational-chemistry
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