A BERT-based pretraining model for extracting molecular structural information from a SMILES sequence.

Xiaofan Zheng Yoichi Tomiura

Published in: J. Cheminformatics (2024)

Keyphrases

structural information
management system
computational model
experimental data
statistical model
high level
objective function
image quality
logical structure
conceptual model
mathematical model
theoretical analysis
data sets
probability distribution
three dimensional
genetic algorithm
neural network