HIF ligand-binding Metadynamics simulation
收藏Figshare2024-09-04 更新2026-04-08 收录
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https://figshare.com/articles/dataset/HIF_ligand-binding_Metadynamics_simulation/26935510/1
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资源简介：
This dataset comprises pre-computed Metadynamics simulation to observe the ligand binding to the Hypoxia Inducible Factor (HIF) PAS-B domain, intended for use with the SOMMD (Self-Organizing Maps for Molecular Dynamics) R package. The files, including .xtc and .gro formats, serve as input data for analysis within a notebook designed to demonstrate the capabilities of the SOMMD R package.
提供机构：
Pandini, Alessandro; Motta, Stefano
创建时间：
2024-09-04
