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Sculpting Molecules in 3D: A Flexible Substructure Aware Framework for Text-Oriented Molecular Optimization.
Kaiwei Zhang
Yange Lin
Guangcheng Wu
Yuxiang Ren
Xuecang Zhang
Bo Wang
Xiaoyu Zhang
Weitao Du
Published in:
CoRR (2024)
Keyphrases
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lightweight
optimization scheme
keywords
main contribution
optimization algorithm
molecular structures
information retrieval
theoretical framework
database
data sets
data mining
text classification
web documents
risk minimization