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GMINPotential.getEnergy()

pele /
Potentials (pele.potentials) /
pele.potentials.GMINPotential /
pele.potentials.GMINPotential.getEnergy

pele.potentials.GMINPotential.getEnergy#

GMINPotential.getEnergy(coords)[source]#: return the energy at the given coordinates

pele.potentials.GMINPotential.getCoords

pele.potentials.GMINPotential.getEnergyGradient

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