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

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

Project Activity

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Categories

Molecular Science, Chemistry, Molecular Mechanics

License

GNU General Public License version 3.0 (GPLv3)

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Additional Project Details

Languages

English

Intended Audience

Science/Research

User Interface

Command-line

Programming Language

C

Related Categories

C Molecular Science Software, C Chemistry Software, C Molecular Mechanics Software

Registered

2010-12-20
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