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19 July 2022

  • curprev 22:1822:18, 19 July 2022 Admin talk contribs 407 bytes +89 No edit summary
  • curprev 22:1522:15, 19 July 2022 Admin talk contribs 318 bytes +318 Created page with " Convert PDB to xyz Features: * It does not change atom order so good for post-MD processing. so it is a one-to-one mapping * It supports other fragments (user needs provide) besides amoebabio18. This is good for, such as, chemical modified residues * Link: https://github.com/leucinw/TIPTOP/blob/main/IP_PDB2txyz.py"
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