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haddocking / pdb-tools

A dependency-free cross-platform swiss army knife for PDB files.
https://haddocking.github.io/pdb-tools/
Apache License 2.0
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Consider HEXADECIMAL for `pdb_fromcif` #121

Open joaomcteixeira opened 2 years ago

joaomcteixeira commented 2 years ago

Consider ~HEXADECIMAL~ hybrid-36 for pdb_fromcif to allow for more than 10000 atoms. Some programs may read this nomenclature:

https://github.com/haddocking/haddock-CSB-tools/blob/master/CAPRI/pdb_tidy.py

kudos to @rvhonorato

rvhonorato commented 2 years ago

All credits go to: https://github.com/cctbx/cctbx_project/blob/master/iotbx/pdb/hybrid_36.py 😉