Protein Ligand Binding Assay
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下载链接：
https://figshare.com/articles/dataset/Protein_Ligand_Binding_Assay/12214769
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资源简介：
MD simulations of a protein ligand binding assay, provided by Acellera. These simulations are used in https://software.acellera.com/docs/latest/htmd/tutorials/ligand-binding-analysis.html
Doerr, S.; Harvey, M. J.; Noé, F.; De Fabritiis, G. HTMD: High-Throughput Molecular Dynamics for Molecular Discovery. J. Chem. Theory Comput. 2016, 12, 1845–1852
创建时间：
2020-04-30
