A novel approach to calculation of conformation: Distance geometry

DOI10.1016/0021-9991(77)90112-7zbMath0367.52013OpenAlexW2061251163MaRDI QIDQ1242333

Gordon M. Crippen

Publication date: 1977

Published in: Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/0021-9991(77)90112-7

Mathematics Subject Classification ID

Dissections and valuations (Hilbert's third problem, etc.) (52B45)

Related Items (6)

The theory and practice of distance geometry ⋮ Use of Caley-Menger determinants in the calculation of molecular structures ⋮ The application of the genetic algorithm to the minimization of potential energy functions ⋮ Rapid calculation of coordinates from distance matrices ⋮ A unified interpretation of stress in molecular systems ⋮ Searching for spreads and packings

Cites Work

• Unnamed Item
• Iteration Methods for Nonlinear Problems
• Function minimization by conjugate gradients

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