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interfaceff2gro. A python script to prepare GROMACS input files using INTERFACE forcefield
OpenVnmrJ. OpenVnmrJ. Build tools and instructions are at ovjTools.
Deep-Chemometrics. Using deep learning approaches and convolutional neural networks (CNN) for spectroscopical data (deep chemometrics)
neofaunus. Sketch for new version of Faunus (DEPRECATED)
openmm. OpenMM is a toolkit for molecular simulation using high performance GPU code.
export_fig. A MATLAB toolbox for exporting publication quality figures
faunus. A Framework for Metropolis Monte Carlo Simulation of Molecular Systems
