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Fig. 11 | Journal of Cheminformatics

Fig. 11

From: A new topological descriptor for water network structure

Fig. 11

PCA of first degree L1NPI space for different numbers of water molecules in TIP3P. Classes defined analogously to Fig. 10—PCA of first degree persistence image space for different numbers of water molecules in TIP3P. Classes are defined by the number of waters removed from the system, where 0 refers to a system with 4287 water molecules

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