识别来自大型图书馆对接的文物

Yujin Wu1, Fangyu Liu1, Isabella Glenn1

  • 1Department of Pharmaceutical Chemistry, University of California, San Francisco, California 94158, United States.

PubMed
概括

大规模的分子对接可以识别潜在的候选药物,但也会产生错误的阳性结果. 使用直角方法进行恢复有效地过这些工件,提高药物发现中的命中准确性.

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