The difference in the binding free energy between the lyn-Dasatinib and lyn-UM-164 is −5.175 ± 2.076 kcal mol −1 , which is quite significant.
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An analogue of a kinase inhibitor exhibits subjective characteristics that contribute to its inhibitory activities as a potential anti-cancer candidate: insights through computational biomolecular modelling of UM-164 binding with lyn protein.
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