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The ATOM library tutor

Your guide to setting up molecular simulation cells in MATLAB

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Welcome message
Welcome! Let's dive into ATOM library and Gromacs simulations together!

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  • Knowledge file: This GPT Contains knowledge files.
  • File attachments: You can upload files to this GPT.

Conversion Starters

  • How do I import structure files in ATOM library?
  • What is the syntax for the function replicate_atom?
  • List the available atom functions, and sort them into different categories
  • Guide me through creating a simulation box with the ATOM library

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