edu.duke.cs.osprey/edu.duke.cs.osprey.gui.forcefield.amber/AmberDefaults/sqmMinimizationSteps

sqmMinimizationSteps

const val sqmMinimizationSteps: Int = 0
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The default value of 0 assumes the input structure should not be perturbed via minimization. ie, 0 minimization steps results in a single point energy calculation.