Trisha Shetty (Editor)

Molecular design software

Updated on
Edit
Like
Comment
Share on FacebookTweet on TwitterShare on LinkedInShare on Reddit

Molecular design software is software for molecular modeling, that provides special support for developing molecular models de novo.

In contrast to the usual molecular modeling programs, such as for molecular dynamics and quantum chemistry, such software directly supports the aspects related to constructing molecular models, including:

  • Molecular graphics
  • interactive molecular drawing and conformational editing
  • building polymeric molecules, crystals, and solvated systems
  • partial charges development
  • geometry optimization
  • support for the different aspects of force field development

    • References

    Molecular design software Wikipedia
    (Text) CC BY-SA