Software

HbMap2grace
HbMap2grace

This software takes xpm files produced by gmx hbond and converts it into a plottable xvg file.

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Porcupine
Porcupine

Shows the vectors obtained from molecular dynamics principal component analysis, or from normal modes, using the VMD program.

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ProtCHOIR
ProtCHOIR

A pipeline for modelling homo-oligomeric complexes.

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SurfinMD
SurfinMD

SurfinMD can be used to calculate the surface of contact between a drug and a protein, separating the results by diferent properties and by amino-acid residues.

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