Our program, known as CAN, creates and uses a library to update charge, atom type, and name the atoms in any molecular structure (mol2) file and streamlines the process for preparing structures for molecular dynamics simulations.

Features

  • Unix Wrapped Code
  • Python Core Code
  • Preparing Structures For Molecular Dynamics Simulations.

Project Samples

AIB naming Can Before CAN After Small Protiens Medium Protiens Large Protiens

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Registered

2021-04-24
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