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QCforever: A Quantum Chemistry Wrapper for Everyone to Use in Black-Box Optimization.
Masato Sumita
Kei Terayama
Ryo Tamura
Koji Tsuda
Published in:
J. Chem. Inf. Model. (2022)
Keyphrases
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black box
black boxes
white box
optimization problems
optimization algorithm
test cases
hybrid systems
integration testing
rule extraction
information retrieval
optimization process
candidate solutions
feature space
optimization method