/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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