Assessing the performance of three resveratrol in binding with SIRT1 by molecular dynamics simulation and MM/GBSA methods: the weakest binding of resveratrol 3 to SIRT1 triggers a possibility of dissociation from its binding site.
Han ChenYan WangZheng GaoWen YangJian GaoPublished in: J. Comput. Aided Mol. Des. (2019)