Title : Complete reconstruction of dasatinib unbinding pathway from c-Src kinase by supervised molecular dynamics simulation method; assessing efficiency and trustworthiness of the method.

Pub. Date : 2021 Sep 2

PMID : 34472425






2 Functional Relationships(s)
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1 Complete reconstruction of dasatinib unbinding pathway from c-Src kinase by supervised molecular dynamics simulation method; assessing efficiency and trustworthiness of the method. Dasatinib C-terminal Src kinase Homo sapiens
2 In this work, we utilized this strategy to reconstruct the unbinding pathway of the anticancer drug dasatinib from its target protein, the c-Src kinase. Dasatinib C-terminal Src kinase Homo sapiens