Molecular Simulation of Stapled Peptides: Supporting Material

A compressed (tar-gzip) archive containing input and analysis scripts, along with partial analysis data, for Chapter 14 of Computational Peptide Science: Methods and Protocols (Thomas Simonson, ed.) entitled "Molecular Simulation of Stapled Peptides" by Victor Ovchinnikov, Aravinda Munasinghe, and Martin Karplus; Methods in Molecular Biology, vol. 2405, https://doi.org/10.1007/978-1-0716-1855-4_14, 2022, Springer.

Protocol citation: Ovchinnikov, V., Munasinghe, A., Karplus, M. (2022). Molecular Simulation of Stapled Peptides. In: Simonson, T. (eds) Computational Peptide Science. Methods in Molecular Biology, vol 2405. Humana, New York, NY. https://doi.org/10.1007/978-1-0716-1855-4_14

Related Organizations

Harvard University
United States

Keywords

Molecular dynamics, Peptide design, MMGBSA, Binding free energy, MDM2, p53

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