PypKa
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  • Pypka
  • Getting Started
  • Development
    • FF Extension
    • Contributing
    • Future Work
  • API Reference
  • Useful Links
PypKa
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  • Development
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DevelopmentΒΆ

  • FF Extension
    • Adding extra residues
    • Add residue block to aa.rtp file
    • Add atom types to ffnonbonded.itp
    • Add placeholder info on DataBaseT_old.crg and DataBaseT_old.siz
    • Run extend_db
    • Add residue to pdb2pqr
  • Contributing
    • Types of Contributions
    • Get Started!
    • Pull Request Guidelines
    • Deploying
  • Future Work
    • Greater Usability
    • Faster Calculations
    • Accuracy Improvement
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© Copyright 2021, Pedro B.P.S. Reis, Diogo Vila-Vicosa, Walter Rocchia, Miguel Machuqueiro Revision d6805d8e.

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