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Use of augmented Lagrangians in the calculation of molecular conformations by distance geometry.
Gordon M. Crippen
Andrew Smellie
Jeffrey W. Peng
Published in:
J. Chem. Inf. Comput. Sci. (1988)
Keyphrases
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three dimensional
distance measure
protein structure prediction
euclidean distance
protein structure
geodesic distance
distance measurement
data mining
x ray
neural network
multiscale
distance function
relative position
geometric features
calculation method
molecular structures