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Molecular docking, 3D-QASR and molecular dynamics simulations of benzimidazole Pin1 inhibitors
Physical Chemistry Chemical PhysicsMolecular docking, 3D-QSAR, dynamics simulations, free energy and decomposition calculation between Pin1 protein and benzimidazole Pin1 inhibitors.
Min Liu+4 more
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Simulation of carbohydrates: from molecular docking to molecular dynamics simulation
2013Sapay, N., Nurisso, A., Imberty, A.
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