OpenFE 2024 Industry Benchmark Project, Results from Genentech. misc: btk

Swope, William; Wei, Binqing; Suriana, Patricia; Purkey, Hans

doi:10.5281/zenodo.14232593

Published November 27, 2024 | Version v1

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OpenFE 2024 Industry Benchmark Project, Results from Genentech. misc: btk

Swope, William¹
Wei, Binqing
Suriana, Patricia
Purkey, Hans

1. Genentech

OpenFE 2024 Industry Benchmark Project. Results from misc: btk. OpenFE Version v1.0.1. Simulation details can be found in the GitHub repository https://github.com/OpenFreeEnergy/IndustryBenchmarks2024

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Zenodo

License: Creative Commons Attribution 4.0 International

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Created: November 28, 2024
Modified: December 14, 2024

OpenFE 2024 Industry Benchmark Project, Results from Genentech. misc: btk

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Files

misc_btk.zip

Files (617.8 MB)