OpenFE 2024 Industry Benchmarking Project, Results from MCS_Docking Renin Set

Published January 14, 2025 | Version v1

Dataset Open

Dataset for the OpenFE Benchmark for the MCS_Docking Renin Set.

openfe, version 1.0.1

Simulation details can be found in the GitHub repository https://github.com/OpenFreeEnergy/IndustryBenchmarks2024

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mcs_docking_renin.zip md5:1f192ab2ff24121e692cbcead6bf9ee8	3.3 GB	Preview Download

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Zenodo

License: Creative Commons Attribution 4.0 International

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