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incorporating suggestions
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flowermd/library/systems.py

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@@ -4,6 +4,7 @@
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import numpy as np
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from scipy.spatial.distance import pdist
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class SingleChainSystem(System):
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"""Builds a box around a single chain.
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@@ -16,7 +17,7 @@ class SingleChainSystem(System):
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"""
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def __init__(self, molecules, base_units=dict(),buffer=1.05):
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self.buffer = buffer
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self.buffer = buffer
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super(SingleChainSystem, self).__init__(
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molecules=molecules,
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base_units=base_units

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