Counting chemical compositions using Ehrhart quasi-polynomials

DOI10.1007/s10910-012-0042-6zbMath1306.92073OpenAlexW2171779441MaRDI QIDQ1930511

Shane L. Hubler, Gheorghe Craciun

Publication date: 11 January 2013

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-012-0042-6

zbMATH Keywords

Ehrhart quasi-polynomialsBarvinok software librarychemical compositionspeptide masses

Mathematics Subject Classification ID

Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Uses Software

• barvinok

Cites Work

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• Mass distributions of linear chain polymers
• Lattice invariant valuations on rational polytopes
• The minimum period of the Ehrhart quasi-polynomial of a rational polytope
• Periodicity in quasipolynomial convolution
• Maximal periods of (Ehrhart) quasi-polynomials
• Computing the period of an Ehrhart quasi-polynomial
• Computing the Continuous Discretely
• Computing the Ehrhart quasi-polynomial of a rational simplex
• Partitions and Their Representative Graphs

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