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Importance of ligand conformational energies in carbohydrate docking: Sorting the wheat from the chaff.
Anita K. Nivedha
Spandana Makeneni
Bethany Lachele Foley
Matthew B. Tessier
Robert J. Woods
Published in:
J. Comput. Chem. (2014)
Keyphrases
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higher order
markov random field
low energy
graph cuts
relative importance
hiv protease
artificial intelligence
social networks
energy minimization
coarse grained
neural network
genetic algorithm
energy function
high throughput
protein folding