Comparison of software for molecular mechanics modeling

This is a list of computer programs that are predominantly used for molecular mechanics calculations.

See also

• Car–Parrinello molecular dynamics
• Comparison of force-field implementations
• Comparison of nucleic acid simulation software
• List of molecular graphics systems
• List of protein structure prediction software
• List of quantum chemistry and solid-state physics software
• List of software for Monte Carlo molecular modeling
• List of software for nanostructures modeling
• Molecular design software
• Molecular dynamics
• Molecular modeling on GPUs
• Molecule editor
• PyMOL

Notes and references

External links

• SINCRIS
• Linux4Chemistry
• Collaborative Computational Project
• World Index of Molecular Visualization Resources
• Short list of Molecular Modeling resources
• OpenScience
• Biological Magnetic Resonance Data Bank
• Materials modelling and computer simulation codes
• A few tips on molecular dynamics
• atomistic.software - atomistic simulation engines and their citation trends