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MGeometricCenter

MGeometricCenter[ hexpr ]
returns the geometric center of hexpr atoms in the set atolist.
MGeometricCenter[ atolist ]
returns the geometric center of the atoms in the set atolist.
  • atolist is a list of molecula hierarchical expressions with heads MAtom.
  • Cartesian coordinates are used to compute the geometric center.
EXAMPLESCLOSE ALL
Basic Examples   (1)
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Loads a sample chain:
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Computes the geometric center of the chain:
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Loads a set of sample atoms:
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Computes the geometric center:
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