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qq0317

铜虫 (小有名气)

[求助] 有关基于含金属离子的蛋白的虚拟筛选的注意事项 已有1人参与

有人知道薛定谔软件中zero-order bond的参数设置在哪里可以看到吗?另外,本人刚接触含金属离子的蛋白的抑制剂筛选,有做过这块的前辈可以教教我在对接过程中该另外注意些什么吗?与二价Fe离子或Ni离子形成二齿螯合的配体在结构上都有怎样的要求呢?请相关研究领域的前辈帮帮我!谢谢!
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Real穗

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【答案】应助回帖

蛋白准备时Import and process 下面有create zero-order bond to mental
2楼2018-08-29 17:13:50
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