Sentence examples for molecular docking methods from inspiring English sources

The probable binding-mode of compound f7 was further analyzed carefully by molecular docking methods.

Pharmacophore search and molecular docking methods were used for construction of the molecular alignments.

The known CB1 ligands are highly diverse structurally, so CB1 receptor may undergo considerable conformational changes to accept different ligands, which is challenging for molecular docking methods.

In this paper pharmacophore mapping, molecular docking methods were employed in a virtual screening strategy to identify leads for FBPase-2.

This study was designed to examine the interaction of demeclocycline (DMCTC) with human serum albumin (HSA) by multi-spectroscopic and molecular docking methods.

Homology modeling, structure based virtual screening and molecular docking methods have been used to find the novel inhibitory compounds against SecA activity at ATP binding region.

Binding mechanisms were studied using Molecular docking method.

Using the glide flexible molecular docking method, twenty structures were chosen for in vitro studies.

A major limitation in current molecular docking method is that of failure to account for receptor flexibility.

Using molecular docking method, we studied the binding of these drugs at an array of receptors present within the physiological system.

In this study, the 3D complex structure of tumor necrosis factor-alpha (TNFα) and its neutralizing monoclonal antibody Z12 was modeled using molecular docking method and optimized with molecular mechanism and dynamics method.