Concept

Molecular design software

Summary
Molecular design software is notable 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
Comparison of software covering the major aspects of molecular design Notes and references See also
About this result
This page is automatically generated and may contain information that is not correct, complete, up-to-date, or relevant to your search query. The same applies to every other page on this website. Please make sure to verify the information with EPFL's official sources.
Related publications

Loading

Related people

Loading

Related units

Loading

Related concepts

Loading

Related courses

Loading

Related lectures

Loading