2 projects
orca-parser
A module for parse ORCA output files including hessians (.hess) files
Martinoid
This module was inspired by martinize (http://cgmartini.nl/index.php/tools2/proteins-and-bilayers/204-martinize) and has been created to perform automatic topology building of peptoids within the MARTINI forcefield (v2.1) in the GROMACS program.
