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BioPhysics

Source codes and data for BioPhysics course on Bioinformatics

forcefield.py

Module for forcefield parameters management

data/vdwprm

Simple vdw parameters (based on AMBER ff using AutoDock compatible atom types)

External dependencies Bio.PDB.PDBParser (Biopython)

data/AA_PDB

Model compounds for the 20 amino acids.

Examples

Code examples for Practical Session I (BioPython)

Exercises

prob217.py

Simple script to solve Exercise 7 form 2.1 collection

prob217_noclass.py

Simple script to solve Exercise 7 form 2.1 collection. Version without python classes

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  • Jupyter Notebook 84.2%
  • Fortran 11.4%
  • Python 2.4%
  • Shell 1.8%
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