Randomly Sampling Molecules

  • Authors:
  • L. A. Goldberg;M. Jerrum

  • Affiliations:
  • -;-

  • Venue:
  • Randomly Sampling Molecules
  • Year:
  • 1996

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Abstract

We give the first polynomial-time algorithm for the following problem: Given a degree sequence in which each degree is bounded from above by a constant, select, uniformly at random, an unlabelled connected multigraph with the given degree sequence. We also give the first polynomial-time algorithm for the following related problem: Given a molecular formula, select, uniformly at random, a structural isomer having the giver formula.