Resources

• LibEFP
• Octopus

External Links

The Sherrill Group

• The Sherrill Research Group

The Slipchenko Group

• The Slipchenko Group Website
• Pradeep K. Gurunathan's Personal Website

The Suspenders

• The Density Functional Times Website
• Martín A. Mosquera's Personal Blog

Manuals of Computational Chemistry Packages

Effective Fragment Potential

• LibEFP Webpage
• LibEFP GitHub Repository

Electronic Structure

• Octopus
• Q-Chem 4.3
• Q-Chem 4.1
• Psi4
• GAMESS
• HyperChem
• NWChem 6.6
• MOPAC2016

Classical Dynamics

• GROMACS
• NAMD

Visualizers

• VMD
• IQmol
• VisIt
• Gabedit
• Macmolplt
• ChemCraft
• Molden
• ChemBioOffice