Molecular dynamics simulation data of designed cyclic peptide (ligand-binding)
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https://zenodo.org/record/3780466
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资源简介：
Trajectories of ligand binding simulation and simulation set-up files of designed cyclic peptide as MDM2 binders.
The original paper of these designed cyclic peptide: Danelius, E., Pettersson, M., Bred, M., Min, J., Waddell, M. B., Guy, R. K., et al. (2016). Flexibility is important for inhibition of the MDM2/p53 protein–protein interaction by cyclic β-hairpins. Org. Biomol. Chem., 14(44), 10386–10393. http://doi.org/10.1039/C6OB01510G
创建时间：
2021-01-11
