Induced-fit docking studies

Docking results of trifluraline and dinitroaniline-etherphospholipid hybrids against different kinetoplastid alpha-tubulin receptors with an induced fit docking routine. The docking protocol involves an initial crude ligand placement step, subsequent receptor optimization in response to ligand binding, and another docking step into the optimized receptor.

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Created: 16th Feb 2023 at 11:14

Last updated: 24th Apr 2023 at 13:36

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