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PubChemQC Project: A Large-Scale First-Principles Electronic Structure Database for Data-Driven Chemistry.
Maho Nakata
Tomomi Shimazaki
Published in:
J. Chem. Inf. Model. (2017)
Keyphrases
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data driven
database
databases
relational databases
data sets
database systems
real world
artificial intelligence
case study
real life
geometric structure
project management
database applications
data management
query language
software development
small scale
learning algorithm
web scale