CS-25-DAT-4-05
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Interatomic-Distance-Example
Interatomic-Distance-Example PublicAn example implementation of Floyd-Warshalls All-Pairs Shortest Path Algorithm for bound-smoothing distances between atom pairs in a molecule represented as a graph. Presented in Chapter 43 of Nvid…
Cuda
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- Interatomic-Distance-Example Public
An example implementation of Floyd-Warshalls All-Pairs Shortest Path Algorithm for bound-smoothing distances between atom pairs in a molecule represented as a graph. Presented in Chapter 43 of Nvidia's GPU GEMS 2 book. Implemented in CUDA C and a premature version of BOLT.
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