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Nathan Baker

PDB2PQR is a Python software package that automates many of the common tasks of preparing structures for continuum electrostatics calculations, providing a platform-independent utility for converting protein files in PDB format to PQR format.

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PDB2PQR command line interface
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The PDB2PQR server in progress
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Results from the PDB2PQR server


Project Admins:


  • Kyle Monson
    Kyle Monson
    2014-11-24

    Bin Tu,

    The appropriate place to ask for help is on the mailing list at

    pdb2pqr-users@lists.sourceforge.net

    Post your question there and I'll reply to it on that forum. After you have sent your message I will delete these comments.

    -Kyle