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Multi-way PLS modeling of structure-activity data by incorporating electrostatic and lipophilic potentials on molecular surface.
Kiyoshi Hasegawa
Shigeo Matsuoka
Masamoto Arakawa
Kimito Funatsu
Published in:
Comput. Biol. Chem. (2003)
Keyphrases
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data sets
data collection
synthetic data
database
raw data
image data
data processing
data analysis
prior knowledge
data quality
missing data
experimental data
activity patterns
structural information
data structure
data sources
network structure
human activities
data points
original data
data model