PeptideBuilder: A simple Python library to generate model peptides

نویسندگان

  • Matthew Z. Tien
  • Dariya K. Sydykova
  • Austin G. Meyer
  • Claus O. Wilke
چکیده

We present a simple Python library to construct models of polypeptides from scratch. The intended use case is the generation of peptide models with pre-specified backbone angles. For example, using our library, one can generate a model of a set of amino acids in a specific conformation using just a few lines of python code. We do not provide any tools for energy minimization or rotamer packing, since powerful tools are available for these purposes. Instead, we provide a simple Python interface that enables one to add residues to a peptide chain in any desired conformation. Bond angles and bond lengths can be manipulated if so desired, and reasonable values are used by default.

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عنوان ژورنال:

دوره 1  شماره 

صفحات  -

تاریخ انتشار 2013