Neighborhood Zagreb Calculator

second-order Zagreb index

CalculatorsFreeNo Signup
4.3(60 reviews)
All Tools

Loading tool...

About Neighborhood Zagreb Calculator

A neighborhood first Zagreb calculator computing NM₁(G) = Σ S(v)² where S(v) = Σ_{u∈N(v)} d(u). Mondal-De-Pal (2019). Second-order Zagreb: uses neighbor-degree sums instead of degrees. More discriminating than classical Zagreb. Client-side.

Neighborhood Zagreb Calculator Features

  • NM₁(G)
  • ΣS(v)²
  • 2nd-order
  • Mondal '19
  • Common graphs
Neighborhood Zagreb NM₁(G) = Σ S(v)² where S(v) = Σ d(neighbors). Second-order version of M₁: replaces d(v) with S(v). Mondal-De-Pal (2019). More discriminating: isospectral graphs can have different NM₁. Better for complex molecular prediction.

How to Use

Select graph:

  • NM₁: Neighborhood Zagreb
  • S(v)²: Per vertex
  • vs M₁: Compare

Better Discrimination

Classical M₁ uses d(v): many non-isomorphic graphs share the same degree sequence. NM₁ uses S(v): captures neighborhood structure beyond degree. Better at distinguishing graphs.

Bounds

For regular d-graphs: NM₁ = n·(d·d)² = n·d⁴. Compare M₁ = n·d² (quadratic). NM₁ grows as d⁴ — much more sensitive to degree.

Step-by-Step Instructions

  1. 1Select graph.
  2. 2Compute S(v) for each vertex.
  3. 3Square each S(v).
  4. 4Sum all S(v)².
  5. 5Compare with M₁.

Neighborhood Zagreb Calculator — Frequently Asked Questions

NM₁ vs M₁?+

M₁ = Σd(v)² (degree squared). NM₁ = ΣS(v)² (neighbor-sum squared). NM₁ captures more: two vertices with same degree can have different S(v) based on neighbor degrees. More discriminating.

Order of information?+

M₁: first-order (own degree). NM₁: second-order (neighbor degrees). One could define NM₁²: third-order (neighbors' neighbors). Each order adds discrimination power but computational cost.

QSAR improvement?+

NM₁ outperforms M₁ for predicting acentric factor and entropy of octane isomers. The second-order information captures molecular branching patterns that first-order misses.

Share this tool: