Tag: #drugdiscovery

Articles related to drugdiscovery

science

Preprint: GPU-Optimized SparkleDock Cuts Flexible Docking Benchmarks from Hours to Seconds

An arXiv preprint says SparkleDock, a GPU-first redesign of flexible docking, cuts benchmark runtimes from hours to seconds on GPU clusters.

#gpus, #drugdiscovery, #docking, #hpc