https://www.selleckchem.com/pr....oducts/Staurosporine
The results show that non-specialists can use either CHARMM36 or GLYCAM06 force fields because both gave comparable results, albeit with small differences. The comparative study shows that the HS hexasaccharide samples a range of conformations with nearly equivalent energies, which could be the reason for its recognition by different proteins. Finally, analysis of the non-direct water bridges across the dynamics trajectory shows their importance in stabilization of certain conformational forms, which may become important for prote
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