/tools/gmx_wheel_plus
gmx_wheel_plus
MagnusBertelsen/gmx_wheel_plus
2 stars0 forksPythonAdded February 8, 2026
summary
gmx_wheel+ is a tool designed for analyzing and visualizing the orientation of helical antimicrobial peptides derived from molecular dynamics simulations. It facilitates the design process by providing advanced projections and analysis of peptide structures, aiding in the development of new analogs.
description
gmx_wheel+ is a tool for analysing and visualizing the orientation of helical antimicobial peptides based on molecular dynamics simulations
topics
antimicrobial-peptidesbilayerbioinformatics-analysisbioinformatics-scriptsbioinformatics-toolbioinformatics-visualizationdrug-designdrug-discoverygromacshelixmicrobiologymolecular-dynamics-simulationorientation-estimationpeptidessimulation
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