Detalhe da pesquisa
1.
The message passing neural networks for chemical property prediction on SMILES.
Methods
; 179: 65-72, 2020 07 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-32445695
2.
Comprehensive ensemble in QSAR prediction for drug discovery.
BMC Bioinformatics
; 20(1): 521, 2019 Oct 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-31655545
3.
Mass spectra prediction with structural motif-based graph neural networks.
Sci Rep
; 14(1): 1400, 2024 Jan 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-38228685
4.
Deep contrastive learning of molecular conformation for efficient property prediction.
Nat Comput Sci
; 3(12): 1015-1022, 2023 Dec.
Artigo
em Inglês
| MEDLINE | ID: mdl-38177719
5.
GeoT: A Geometry-Aware Transformer for Reliable Molecular Property Prediction and Chemically Interpretable Representation Learning.
ACS Omega
; 8(42): 39759-39769, 2023 Oct 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-37901490
6.
Deep learning-based prediction for significant coronary artery stenosis on coronary computed tomography angiography in asymptomatic populations.
Front Cardiovasc Med
; 10: 1167468, 2023.
Artigo
em Inglês
| MEDLINE | ID: mdl-37416918
7.
Flexible Dual-Branched Message-Passing Neural Network for a Molecular Property Prediction.
ACS Omega
; 7(5): 4234-4244, 2022 Feb 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-35155916
8.
Brain-inspired Predictive Coding Improves the Performance of Machine Challenging Tasks.
Front Comput Neurosci
; 16: 1062678, 2022.
Artigo
em Inglês
| MEDLINE | ID: mdl-36465966
9.
Development and Validation of a Next-Generation Sequencing-Based Multigene Assay to Predict the Prognosis of Estrogen Receptor-Positive, HER2-Negative Breast Cancer.
Clin Cancer Res
; 26(24): 6513-6522, 2020 12 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-33028590