Xinyi Fang

Chak Fong Chong, Xinyi Fang, Jielong Guo et al.

Large-scale image datasets are often partially labeled, where only a few categories' labels are known for each image. Assigning pseudo-labels to unknown labels to gain additional training signals has become prevalent for training deep classification models. However, some pseudo-labels are inevitably incorrect, leading to a notable decline in the model classification performance. In this paper, we propose a novel method called Category-wise Fine-Tuning (CFT), aiming to reduce model inaccuracies caused by the wrong pseudo-labels. In particular, CFT employs known labels without pseudo-labels to fine-tune the logistic regressions of trained models individually to calibrate each category's model predictions. Genetic Algorithm, seldom used for training deep models, is also utilized in CFT to maximize the classification performance directly. CFT is applied to well-trained models, unlike most existing methods that train models from scratch. Hence, CFT is general and compatible with models trained with different methods and schemes, as demonstrated through extensive experiments. CFT requires only a few seconds for each category for calibration with consumer-grade GPUs. We achieve state-of-the-art results on three benchmarking datasets, including the CheXpert chest X-ray competition dataset (ensemble mAUC 93.33%, single model 91.82%), partially labeled MS-COCO (average mAP 83.69%), and Open Image V3 (mAP 85.31%), outperforming the previous bests by 0.28%, 2.21%, 2.50%, and 0.91%, respectively. The single model on CheXpert has been officially evaluated by the competition server, endorsing the correctness of the result. The outstanding results and generalizability indicate that CFT could be substantial and prevalent for classification model development. Code is available at: https://github.com/maxium0526/category-wise-fine-tuning.

Xinyi Fang, Xu Yang, Chak Fong Chong et al.

Accurate classification of laryngeal vascular as benign or malignant is crucial for early detection of laryngeal cancer. However, organizations with limited access to laryngeal vascular images face challenges due to the lack of large and homogeneous public datasets for effective learning. Distinguished from the most familiar works, which directly transfer the ImageNet pre-trained models to the target domain for fine-tuning, this work pioneers exploring two-step heterogeneous transfer learning (THTL) for laryngeal lesion classification with nine deep-learning models, utilizing the diabetic retinopathy color fundus images, semantically non-identical yet vascular images, as the intermediate domain. Attention visualization technique, Layer Class Activate Map (LayerCAM), reveals a novel finding that yet the intermediate and the target domain both reflect vascular structure to a certain extent, the prevalent radial vascular pattern in the intermediate domain prevents learning the features of twisted and tangled vessels that distinguish the malignant class in the target domain, summarizes a vital rule for laryngeal lesion classification using THTL. To address this, we introduce an enhanced fine-tuning strategy in THTL called Step-Wise Fine-Tuning (SWFT) and apply it to the ResNet models. SWFT progressively refines model performance by accumulating fine-tuning layers from back to front, guided by the visualization results of LayerCAM. Comparison with the original THTL approach shows significant improvements. For ResNet18, the accuracy and malignant recall increases by 26.1% and 79.8%, respectively, while for ResNet50, these indicators improve by 20.4% and 62.2%, respectively.

Saejin Oh, Xinyi Fang, I-Hsin Lin et al.

The development of automated experimental facilities and the digitization of experimental data have introduced numerous opportunities to radically advance chemical laboratories. As many laboratory tasks involve predicting and understanding previously unknown chemical relationships, machine learning (ML) approaches trained on experimental data can substantially accelerate the conventional design-build-test-learn process. This outlook article aims to help chemists understand and begin to adopt ML predictive models for a variety of laboratory tasks, including experimental design, synthesis optimization, and materials characterization. Furthermore, this article introduces how artificial intelligence (AI) agents based on large language models can help researchers acquire background knowledge in chemical or data science and accelerate various aspects of the discovery process. We present three case studies in distinct areas to illustrate how ML models and AI agents can be leveraged to reduce time-consuming experiments and manual data analysis. Finally, we highlight existing challenges that require continued synergistic effort from both experimental and computational communities to address.