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sdf2xyz2sdf

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Description

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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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

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Additional Project Details

Languages

English

Intended Audience

Science/Research

User Interface

Command-line

Programming Language

C

Registered

2010-12-20

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