/tools/vermouth-martinize

vermouth-martinize

marrink-lab/vermouth-martinize

139 stars54 forksPythonAdded February 4, 2026
summary

Vermouth and Martinize2 are tools for generating coarse-grained structures and topologies from atomistic molecular structures. They utilize graph algorithms to describe and apply transformations, primarily aimed at enhancing molecular dynamics simulations.

description

Describe and apply transformation on molecular structures and topologies

topics

molecular-dynamicshacktoberfest

Ratings

N/A
0 ratings

Rate this tool:

Comments (0)

Sign in to leave a comment.

No comments yet. Be the first to share your thoughts!