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

See All Activity >

Categories

Molecular Science, Chemistry, Molecular Mechanics

License

GNU General Public License version 3.0 (GPLv3)

Follow sdf2xyz2sdf

sdf2xyz2sdf Web Site

Other Useful Business Software
Auth for GenAI | Auth0 Icon
Auth for GenAI | Auth0

Enable AI agents to securely access tools, workflows, and data with fine-grained control and just a few lines of code.

Easily implement secure login experiences for AI Agents - from interactive chatbots to background workers with Auth0. Auth for GenAI is now available in Developer Preview
Try free now
Rate This Project
Login To Rate This Project

User Reviews

Be the first to post a review of sdf2xyz2sdf!

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
Report inappropriate content