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Molecular docking was first performed as a primary screening for natural compounds targeting Annexin A2.
Molecular docking was performed on the active site of MK-2 with good results.
First, molecular docking was used to explore the interactions between BphA and 209 PCB congeners.
Meanwhile, molecular docking was used to verify the theoretical calculations in this experiment.
To investigate the ability of natural products to inhibit PPI targets, molecular docking was used.
Molecular docking was employed to validate the results of the HQSAR and topomer CoMFA models.
Flexible molecular docking was performed using MVD (Molegro Virtual Docker) after receptor and ligand preparation.
The structure based approach (molecular docking) was performed on a series of thiophene derivatives.
Molecular docking was employed to study interactions within the AChE active site.
In addition, molecular docking was performed to rationalize the efficiency of the better compounds.
Flexible molecular docking was used to analyze the structure activity relationships (SARs) of the compounds.
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