gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.
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Updated
May 23, 2026 - Python
gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.
Free WordPress Plugin: Instantly calculate kinetic energy, mass, or velocity using the KE = 1/2 mv² formula. Fast, free, and accurate Kinetic Energy Calculator for physics problems. www.calculator.io/kinetic-energy-calculator/
xBFreE is a powerful and versatile tool for computing the Binding Free Energies using a variety of methods across popular Molecular Dynamics programs
CSMS simulator for electric vehicle charging sessions using mocked JSON data inspired by the OCPP 1.6 protocol. Includes power, energy, and cost calculations to model host-based charging networks
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