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Table 4 First, second and third order NS—matrices for Isonicotinic Acid, obtained by applying three types of topological constraints (cut-off): Self-Returning Walks (SRW), Non-Self-Returning Walks (NSRW) and a topological path cut-off distance from 2 to 5 (LAG [2–5])

From: QuBiLS-MAS, open source multi-platform software for atom- and bond-based topological (2D) and chiral (2.5D) algebraic molecular descriptors computations