Plas-5k dataset
收藏Figshare2022-07-27 更新2026-04-08 收录
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https://figshare.com/articles/dataset/Plas-5k_dataset/19069604/1
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资源简介：
This CSV file contains the Binding Affinity and other important features obtained by simulating 5000 protein-ligand complexes. The calculations were performed using MM-PBSA. <br>It should be noted that all the energy values are in kcal/mol unit.
提供机构：
Sridharan, Bhuvanesh; Sharma, Shubham; Priyakumar U, Deva; Modee, Rohit; C.S, Vasavi; Jeurkar, Shruti; Roy, Subhajit; Bhati, Agastya; B. Korlepara, Divya; muvva, charuvaka; Mehta, Sarvesh; Garg, Akshit; Nayar, Divya; Pal, Pradeep; Kumar, Vishal
创建时间：
2022-07-27
