Freely Available Conformer Generation Methods: How Good Are They?

Jean-Paul Ebejer Garrett M. Morris Charlotte M. Deane

Published in: J. Chem. Inf. Model. (2012)

Keyphrases

databases
computational cost
preprocessing
benchmark datasets
recent developments
information systems
high dimensional
significant improvement
hidden markov models
classification method
missing values
qualitative and quantitative
methods require