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Density
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The Density command calculates the mean system density for single topology systems.
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Energy
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The Energy command calculates the potential energy of the system. |
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FeatureMap
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The FeatureMap command creates a feature map for a given protein structure. |
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Solvator
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The Solvator command adds a box of solvent and optionally couter-ions around a
solute.
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Timer
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The Timer command times the computation of the potential energy and gradient. |
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Volume
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The Volume command calculates the surface area and volume using the GaussVol
(default) or Connolly algorithm.
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