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sdf2xyz2sdf

Posted on by Robin Ding Leave a comment Chemistry, Molecular Mechanics, Molecular Science

An open-source software to convert SDF files into TINKER XYZ files (and viceversa) with automatic assignment of MMFF94 atom types, bond types and charges

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Website http://sdf2xyz2sdf.sourceforge.net
Tags
License GNU General Public License version 3.0 (GPLv3)
Features
  • Automatic assignment of MMFF atom and bond types
  • Works with multi-molecule SDF files
  • Works with V2000 and V3000 SDF files
  • Any format can be converted to TINKER XYZ through OpenBabel