Explainability

可解释性
  • 文章类型: Journal Article
    克罗恩病(CD)是一种不明原因的慢性炎症性肠病,其进展可引起严重的残疾和发病。由于CD的独特性质,许多患者在其一生中经常需要手术,术后并发症发生率高,会影响患者的预后。因此,识别和处理术后并发症至关重要.机器学习(ML)在医学领域变得越来越重要,基于ML的模型可用于预测CD肠切除术的术后并发症。最近,Wang等人发表了一篇有价值的文章,题为“预测克罗恩病肠切除术后的短期主要并发症:一项基于机器学习的研究”。我们欣赏作者的创造性工作,我们愿意分享我们的观点,并与作者讨论。
    Crohn\'s disease (CD) is a chronic inflammatory bowel disease of unknown origin that can cause significant disability and morbidity with its progression. Due to the unique nature of CD, surgery is often necessary for many patients during their lifetime, and the incidence of postoperative complications is high, which can affect the prognosis of patients. Therefore, it is essential to identify and manage postoperative complications. Machine learning (ML) has become increasingly important in the medical field, and ML-based models can be used to predict postoperative complications of intestinal resection for CD. Recently, a valuable article titled \"Predicting short-term major postoperative complications in intestinal resection for Crohn\'s disease: A machine learning-based study\" was published by Wang et al. We appreciate the authors\' creative work, and we are willing to share our views and discuss them with the authors.
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  • 文章类型: Journal Article
    对网络组件之间的动态交互进行建模对于揭示复杂网络的演化机制至关重要。最近,时空图学习方法在表征节点间关系(INR)的动态变化方面取得了值得注意的成果。然而,挑战依然存在:INR的空间邻域开发不足,INRs动态变化中的时空依赖性被忽视,忽略了历史状态和地方信息的影响。此外,该模型的可解释性一直没有得到充分研究。为了解决这些问题,我们提出了一个可解释的时空图进化学习(ESTGEL)模型来对INR的动态演化进行建模。具体来说,提出了一种边缘注意模块,以在多级上利用INR的空间邻域,即,通过分解初始节点关系图得出的嵌套子图的层次结构。随后,提出了一个动态关系学习模块来捕获INR的时空依赖性。然后将INR用作相邻信息以改善节点表示,从而全面描绘了网络的动态演变。最后,该方法得到了大脑发育研究的真实数据的验证。动态脑网络分析的实验结果表明,在整个开发过程中,脑功能网络从分散过渡到更收敛和模块化的结构。在与包括情绪控制在内的功能相关的动态功能连接(dFC)中观察到显着变化,决策,和语言处理。
    Modeling dynamic interactions among network components is crucial to uncovering the evolution mechanisms of complex networks. Recently, spatio-temporal graph learning methods have achieved noteworthy results in characterizing the dynamic changes of inter-node relations (INRs). However, challenges remain: The spatial neighborhood of an INR is underexploited, and the spatio-temporal dependencies in INRs\' dynamic changes are overlooked, ignoring the influence of historical states and local information. In addition, the model\'s explainability has been understudied. To address these issues, we propose an explainable spatio-temporal graph evolution learning (ESTGEL) model to model the dynamic evolution of INRs. Specifically, an edge attention module is proposed to utilize the spatial neighborhood of an INR at multi-level, i.e., a hierarchy of nested subgraphs derived from decomposing the initial node-relation graph. Subsequently, a dynamic relation learning module is proposed to capture the spatio-temporal dependencies of INRs. The INRs are then used as adjacent information to improve the node representation, resulting in comprehensive delineation of dynamic evolution of the network. Finally, the approach is validated with real data on brain development study. Experimental results on dynamic brain networks analysis reveal that brain functional networks transition from dispersed to more convergent and modular structures throughout development. Significant changes are observed in the dynamic functional connectivity (dFC) associated with functions including emotional control, decision-making, and language processing.
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  • 文章类型: Journal Article
    与这些属性和关系相关的句子被忽略了。本文►我们提出了一种称为知识图谱增强神经网络(KGENet)的端到端模型来解决上述缺点。具体►我们首先构建一个疾病知识图,重点关注ICD代码的多视图疾病属性以及这些代码之间的疾病关系。我们还使用长序列编码器来获取EHR文档表示。最重要的►KGENet利用多视图疾病属性和结构化疾病关系,通过混合注意力和图传播►分别增强知识。此外►上述过程可以为基于我们的疾病知识图的模型预测结果提供属性感知和关系增强的可解释性。在MIMIC-III基准数据集上进行的实验表明,KGENet在模型有效性和可解释性方面均优于最先进的模型。电子健康记录(EHR)编码将国际疾病分类(ICD)代码分配给每个EHR文档。这些标准医疗代码代表诊断或程序,在医疗应用中起着至关重要的作用。然而,EHR是一个很长的医学文本,很难代表,ICD代码标签空间很大,标签的分布极不平衡。这些因素对自动EHR编码提出了挑战。以前的研究没有探索疾病的属性(例如,症状,测试,药物)ICD代码和疾病关系(例如,原因,危险因素,它们之间的合并症)。此外,医学的重要作用。
    And sentences associated with these attributes and relationships have been neglected. in this paper ►We propose an end-to-end model called Knowledge Graph Enhanced neural network (KGENet) to address the above shortcomings. specifically ►We first construct a disease knowledge graph that focuses on the multi-view disease attributes of ICD codes and the disease relationships between these codes. we also use a long sequence encoder to get EHR document representation. most importantly ►KGENet leverages multi-view disease attributes and structured disease relationships for knowledge enhancement through hybrid attention and graph propagation ►Respectively. furthermore ►The above processes can provide attribute-aware and relationship-augmented explainability for the model prediction results based on our disease knowledge graph. experiments conducted on the MIMIC-III benchmark dataset show that KGENet outperforms state-of-the-art models in both model effectiveness and explainability Electronic health record (EHR) coding assigns International Classification of Diseases (ICD) codes to each EHR document. These standard medical codes represent diagnoses or procedures and play a critical role in medical applications. However, EHR is a long medical text that is difficult to represent, the ICD code label space is large, and the labels have an extremely unbalanced distribution. These factors pose challenges to automatic EHR coding. Previous studies have not explored the disease attributes (e.g., symptoms, tests, medications) of ICD codes and the disease relationships (e.g., causes, risk factors, comorbidities) between them. In addition, the important roles of medical.
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  • 文章类型: Journal Article
    目的:乳腺癌是一种多面性疾病,其特点是具有多种特征和相当高的死亡率,强调及时发现和干预的必要性。近年来,利用多组学数据来识别乳腺癌中的生物标志物和分类亚型已经获得了重要的吸引力。这种从局部到整体的研究思路也将是未来生命科学研究的必然趋势。深度学习可以整合和分析多组学数据来预测癌症亚型,这可以进一步推动靶向治疗。然而,很少有文章利用深度学习的性质进行特征选择。因此,本文提出了一种基于神经网络和二进制灰狼优化的BreastCAncer生物标记(NNBGWO-BRCAMarker)发现框架,利用多组学数据获得一系列生物标志物,用于对乳腺癌亚型进行精确分类。
    方法:NNBGWO-BRCAMarker包括两个阶段:在第一阶段,使用从训练的前馈神经网络获得的权重选择相关基因;在第二阶段,利用二进制灰狼优化算法进一步筛选所选基因,导致一组潜在的乳腺癌生物标志物。
    结果:使用NNGBO-BRCAMarker鉴定的80种生物标志物进行训练时,具有RBF内核的SVM分类器实现了0.9242±0.03的分类精度,实验结果证明了这一点。我们进行了全面的基因集分析,预后分析,和可药用性分析,揭示了25个药物基因,16个富集途径与乳腺癌的特定亚型密切相关,和8个与预后结果相关的基因。
    结论:提出的框架成功地从多组数据中鉴定出80个生物标志物,能够准确分类乳腺癌亚型。这一发现可能为临床医生在进一步研究中提供新的见解。
    OBJECTIVE: Breast cancer is a multifaceted condition characterized by diverse features and a substantial mortality rate, underscoring the imperative for timely detection and intervention. The utilization of multi-omics data has gained significant traction in recent years to identify biomarkers and classify subtypes in breast cancer. This kind of research idea from part to whole will also be an inevitable trend in future life science research. Deep learning can integrate and analyze multi-omics data to predict cancer subtypes, which can further drive targeted therapies. However, there are few articles leveraging the nature of deep learning for feature selection. Therefore, this paper proposes a Neural Network and Binary grey Wolf Optimization based BReast CAncer bioMarker (NNBGWO-BRCAMarker) discovery framework using multi-omics data to obtain a series of biomarkers for precise classification of breast cancer subtypes.
    METHODS: NNBGWO-BRCAMarker consists of two phases: in the first phase, relevant genes are selected using the weights obtained from a trained feedforward neural network; in the second phase, the binary grey wolf optimization algorithm is leveraged to further screen the selected genes, resulting in a set of potential breast cancer biomarkers.
    RESULTS: The SVM classifier with RBF kernel achieved a classification accuracy of 0.9242 ± 0.03 when trained using the 80 biomarkers identified by NNBGWO-BRCAMarker, as evidenced by the experimental results. We conducted a comprehensive gene set analysis, prognostic analysis, and druggability analysis, unveiling 25 druggable genes, 16 enriched pathways strongly linked to specific subtypes of breast cancer, and 8 genes linked to prognostic outcomes.
    CONCLUSIONS: The proposed framework successfully identified 80 biomarkers from the multi-omics data, enabling accurate classification of breast cancer subtypes. This discovery may offer novel insights for clinicians to pursue in further studies.
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  • 文章类型: Journal Article
    目的:在CT扫描中有效分割食管鳞癌病灶对辅助诊断和治疗具有重要意义。然而,由于食道的不规则形式和小尺寸,准确的病变分割仍然是一项具有挑战性的任务,时空结构的不一致性,食管及其周围组织在医学图像中的对比度较低。目的提高食管鳞状细胞癌病灶的分割效果。
    方法:对于分割网络而言,有效提取3D判别特征以将食管癌与一些视觉上封闭的邻近食管组织和器官区分开来至关重要。在这项工作中,有效的HRU-Net架构(高分辨率U-Net)被用于CT切片中的食管癌和食管癌分割。基于先定位后分割的思想,HRU-Net在分割前定位食管区域。此外,设计了一个分辨率融合模块(RFM),将相邻分辨率特征图的信息进行融合,以及保留高分辨率的功能。
    结果:与其他五种典型方法相比,设计的HRU-Net能够产生优异的分割结果。
    结论:我们提出的HRU-NET提高了食管鳞癌分割的准确性。与其他型号相比,我们的模型表现最好。该方法可提高临床诊断食管鳞癌病变的效率。
    OBJECTIVE: The effective segmentation of esophageal squamous carcinoma lesions in CT scans is significant for auxiliary diagnosis and treatment. However, accurate lesion segmentation is still a challenging task due to the irregular form of the esophagus and small size, the inconsistency of spatio-temporal structure, and low contrast of esophagus and its peripheral tissues in medical images. The objective of this study is to improve the segmentation effect of esophageal squamous cell carcinoma lesions.
    METHODS: It is critical for a segmentation network to effectively extract 3D discriminative features to distinguish esophageal cancers from some visually closed adjacent esophageal tissues and organs. In this work, an efficient HRU-Net architecture (High-Resolution U-Net) was exploited for esophageal cancer and esophageal carcinoma segmentation in CT slices. Based on the idea of localization first and segmentation later, the HRU-Net locates the esophageal region before segmentation. In addition, an Resolution Fusion Module (RFM) was designed to integrate the information of adjacent resolution feature maps to obtain strong semantic information, as well as preserve the high-resolution features.
    RESULTS: Compared with the other five typical methods, the devised HRU-Net is capable of generating superior segmentation results.
    CONCLUSIONS: Our proposed HRU-NET improves the accuracy of segmentation for squamous esophageal cancer. Compared to other models, our model performs the best. The designed method may improve the efficiency of clinical diagnosis of esophageal squamous cell carcinoma lesions.
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  • 文章类型: Journal Article
    高效的食品安全风险评估显著影响食品安全监管。然而,不同种类和批次的食品检测数据呈现不同的特征分布,导致大多数风险评估模型的检测结果不稳定,缺乏风险分类的可解释性,和风险可追溯性不足。本研究旨在探索一种考虑稳健性的高效食品安全风险评估模型,可解释性和可追溯性。因此,提出了基于经验累积分布函数的可解释无监督风险预警框架。首先,通过计算每个检测指标的经验累积分布,将检测数据的基础分布估计为非参数。接下来,根据这些分布估计每个测试指标的尾部概率,并汇总得到样本风险值。最后,“3σ规则”用于实现合格样本的可解释风险分类,并根据各检测指标的风险评分跟踪不合格样本的原因。EWFED模型在实际应用场景中两类乳制品检测数据上的实验验证了其有效性,实现可解释的风险划分和不合格样本的风险追踪。因此,本研究提供了一种更为稳健、系统的食品安全风险评估方法,有效促进食品安全风险的精准管控。
    Efficient food safety risk assessment significantly affects food safety supervision. However, food detection data of different types and batches show different feature distributions, resulting in unstable detection results of most risk assessment models, lack of interpretability of risk classification, and insufficient risk traceability. This study aims to explore an efficient food safety risk assessment model that takes into account robustness, interpretability and traceability. Therefore, the Explainable unsupervised risk Warning Framework based on the Empirical cumulative Distribution function (EWFED) was proposed. Firstly, the detection data\'s underlying distribution is estimated as non-parametric by calculating each testing indicator\'s empirical cumulative distribution. Next, the tail probabilities of each testing indicator are estimated based on these distributions and summarized to obtain the sample risk value. Finally, the \"3σ Rule\" is used to achieve explainable risk classification of qualified samples, and the reasons for unqualified samples are tracked according to the risk score of each testing indicator. The experiments of the EWFED model on two types of dairy product detection data in actual application scenarios have verified its effectiveness, achieving interpretable risk division and risk tracing of unqualified samples. Therefore, this study provides a more robust and systematic food safety risk assessment method to promote precise management and control of food safety risks effectively.
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  • 文章类型: Journal Article
    图形神经网络(GNN)由于缺乏透明度,通常被视为黑匣子。这阻碍了它们在关键领域的应用。已经提出了许多解释方法来解决GNN的可解释性问题。这些解释方法从不同的角度揭示了关于图形的解释信息。然而,解释性信息也可能对GNN模型构成攻击风险。在这项工作中,我们将从解释子图的角度探讨这个问题。为此,我们利用一个强大的GNN解释方法,称为SubgraphX,并在本地部署它,从给定的图中获得解释性子图。然后,我们提出了基于本地解释器进行规避攻击和后门攻击的方法。在逃避攻击中,攻击者从本地解释器获取测试图的解释性子图,并将其解释性子图替换为其他标签的解释性子图,使目标模型错误地将测试图分类为错误的标签。在后门攻击中,攻击者使用本地解释器来选择解释性触发器并找到合适的注入位置。我们验证了我们提出的攻击对最先进的GNN模型和不同数据集的有效性。结果还表明,我们提出的后门攻击更有效,适应性强,比以前的后门攻击更隐蔽。
    Graph Neural Networks (GNNs) are often viewed as black boxes due to their lack of transparency, which hinders their application in critical fields. Many explanation methods have been proposed to address the interpretability issue of GNNs. These explanation methods reveal explanatory information about graphs from different perspectives. However, the explanatory information may also pose an attack risk to GNN models. In this work, we will explore this problem from the explanatory subgraph perspective. To this end, we utilize a powerful GNN explanation method called SubgraphX and deploy it locally to obtain explanatory subgraphs from given graphs. Then we propose methods for conducting evasion attacks and backdoor attacks based on the local explainer. In evasion attacks, the attacker gets explanatory subgraphs of test graphs from the local explainer and replace their explanatory subgraphs with an explanatory subgraph of other labels, making the target model misclassify test graphs as wrong labels. In backdoor attacks, the attacker employs the local explainer to select an explanatory trigger and locate suitable injection locations. We validate the effectiveness of our proposed attacks on state-of-art GNN models and different datasets. The results also demonstrate that our proposed backdoor attack is more efficient, adaptable, and concealed than previous backdoor attacks.
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  • 文章类型: Journal Article
    这项研究旨在全面评估基于非对比计算机断层扫描(CT)的影像组学,以预测严重动脉粥样硬化性肾动脉狭窄(ARAS)患者经皮肾腔内血管成形术(PTRA)后的早期结局。回顾性招募了52例患者,并收集其临床特征和预处理后的CT图像。在3.7个月的中位随访期间,18名患者被证实从治疗中受益,定义为估计的肾小球滤过率比基线改善20%。通过自监督学习训练的深度学习网络用于增强成像表型特征。影像组学功能,包括116个手工制作的功能和78个深度学习功能,从受影响的肾脏和肾周脂肪区域提取。后者的更多特征与早期结果相关,由单变量分析确定,并在影像组学热图和火山图中直观地呈现。在使用一致性聚类和最小绝对收缩和选择算子方法进行特征选择之后,对五种机器学习模型进行了评估。Logistic回归得出肾脏特征的最高留一交叉验证准确性为0.780(95CI:0.660-0.880),而支持向量机的肾周脂肪特征达到0.865(95CI:0.769-0.942)。Shapley加法扩张被用来直观地解释预测机制,直方图特征和深度学习特征被确定为肾脏特征和肾周脂肪特征的最有影响力的因素,分别。多变量分析显示,这两个特征都是独立的预测因素。当组合时,他们获得了0.888(95CI:0.784-0.992)的接收器工作特征曲线下面积,表明来自两个区域的成像表型互补.总之,基于非对比CT的影像组学可用于预测PTRA的早期结果,从而帮助确定适合这种治疗的ARAS患者,肾周脂肪组织提供了额外的预测价值。
    This study aimed to comprehensively evaluate non-contrast computed tomography (CT)-based radiomics for predicting early outcomes in patients with severe atherosclerotic renal artery stenosis (ARAS) after percutaneous transluminal renal angioplasty (PTRA). A total of 52 patients were retrospectively recruited, and their clinical characteristics and pretreatment CT images were collected. During a median follow-up period of 3.7 mo, 18 patients were confirmed to have benefited from the treatment, defined as a 20% improvement from baseline in the estimated glomerular filtration rate. A deep learning network trained via self-supervised learning was used to enhance the imaging phenotype characteristics. Radiomics features, comprising 116 handcrafted features and 78 deep learning features, were extracted from the affected renal and perirenal adipose regions. More features from the latter were correlated with early outcomes, as determined by univariate analysis, and were visually represented in radiomics heatmaps and volcano plots. After using consensus clustering and the least absolute shrinkage and selection operator method for feature selection, five machine learning models were evaluated. Logistic regression yielded the highest leave-one-out cross-validation accuracy of 0.780 (95%CI: 0.660-0.880) for the renal signature, while the support vector machine achieved 0.865 (95%CI: 0.769-0.942) for the perirenal adipose signature. SHapley Additive exPlanations was used to visually interpret the prediction mechanism, and a histogram feature and a deep learning feature were identified as the most influential factors for the renal signature and perirenal adipose signature, respectively. Multivariate analysis revealed that both signatures served as independent predictive factors. When combined, they achieved an area under the receiver operating characteristic curve of 0.888 (95%CI: 0.784-0.992), indicating that the imaging phenotypes from both regions complemented each other. In conclusion, non-contrast CT-based radiomics can be leveraged to predict the early outcomes of PTRA, thereby assisting in identifying patients with ARAS suitable for this treatment, with perirenal adipose tissue providing added predictive value.
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  • 文章类型: Journal Article
    开发用于预测有机化合物与羟基自由基的反应常数的准确且可解释的模型对于推进污染物降解中的定量结构-活性关系(QSAR)至关重要。像分子描述符这样的方法,分子指纹,团体出资方法有局限性,因为传统机器学习难以同时捕获所有分子内信息。为了解决这个问题,我们建立了一个具有大约1200万个可学习参数的集成图神经网络(GNN)。GNN将原子表示为节点,将化学键表示为边缘,从而将分子转化为图形结构,有效地捕获微观性质,同时在非欧几里得空间中描绘原子连通性。我们的数据集包括1401污染物,以开发具有贝叶斯优化的集成GNN模型,模型在训练中达到0.165、0.172和0.189的均方根误差,验证,和测试数据集,分别。此外,我们使用分子指纹来评估分子结构相似性,以增强模型的适用性。之后,我们提出了一种用于模型可解释性的梯度权重映射方法,从人工智能的角度揭示化学反应中的关键官能团,这将通过人工智能增强化学的极端算术能力。
    The development of accurate and interpretable models for predicting reaction constants of organic compounds with hydroxyl radicals is vital for advancing quantitative structure-activity relationships (QSAR) in pollutant degradation. Methods like molecular descriptors, molecular fingerprinting, and group contribution methods have limitations, as traditional machine learning struggles to capture all intramolecular information simultaneously. To address this, we established an integrated graph neural network (GNN) with approximately 12 million learnable parameters. GNN represents atoms as nodes and chemical bonds as edges, thus transforming molecules into a graph structures, effectively capturing microscopic properties while depicting atom connectivity in non-Euclidean space. Our datasets comprise 1401 pollutants to develop an integrated GNN model with Bayesian optimization, the model achieves root mean square errors of 0.165, 0.172, and 0.189 on the training, validation, and test datasets, respectively. Furthermore, we assess molecular structure similarity using molecular fingerprint to enhance the model\'s applicability. Afterwards, we propose a gradient weight mapping method for model explainability, uncovering the key functional groups in chemical reactions in artificial intelligence perspective, which would boost chemistry through artificial intelligence extreme arithmetic power.
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  • 文章类型: Journal Article
    目的:精确的皮质性白内障(CC)分类在早期白内障干预和手术中起着重要作用。前段光学相干断层扫描(AS-OCT)图像在白内障诊断中显示出出色的潜力。然而,由于CC的复杂不透明度分布,基于AS-OCT的自动CC分类很少被研究。在本文中,我们旨在探索CC作为临床先验的不透明度分布特征,以增强深度卷积神经网络(CNN)在CC分类任务中的表示能力。
    方法:我们提出了一种新颖的建筑单元,多风格空间注意力模块(MSSA),通过利用不同的临床环境重新校准中间特征图。MSSA首先通过分组风格池(GSP)提取临床风格背景特征,然后用局部变换(LT)细化临床风格上下文特征,最后通过样式特征重新校准(SFR)执行分组特征图重新校准。MSSA可以轻松地集成到现代CNN中,开销可以忽略不计。
    结果:在CASIA2AS-OCT数据集和两个公共眼科数据集上进行的大量实验证明了MSSA优于最先进的注意力方法。进行可视化分析和消融研究,以提高MSSA在决策过程中的可解释性。
    结论:我们提出的MSSANet利用CC的不透明度分布特征来增强深度卷积神经网络(CNN)的表示能力和可解释性,并改善CC分类性能。我们提出的方法在早期临床CC诊断中具有潜力。
    OBJECTIVE: Precise cortical cataract (CC) classification plays a significant role in early cataract intervention and surgery. Anterior segment optical coherence tomography (AS-OCT) images have shown excellent potential in cataract diagnosis. However, due to the complex opacity distributions of CC, automatic AS-OCT-based CC classification has been rarely studied. In this paper, we aim to explore the opacity distribution characteristics of CC as clinical priori to enhance the representational capability of deep convolutional neural networks (CNNs) in CC classification tasks.
    METHODS: We propose a novel architectural unit, Multi-style Spatial Attention module (MSSA), which recalibrates intermediate feature maps by exploiting diverse clinical contexts. MSSA first extracts the clinical style context features with Group-wise Style Pooling (GSP), then refines the clinical style context features with Local Transform (LT), and finally executes group-wise feature map recalibration via Style Feature Recalibration (SFR). MSSA can be easily integrated into modern CNNs with negligible overhead.
    RESULTS: The extensive experiments on a CASIA2 AS-OCT dataset and two public ophthalmic datasets demonstrate the superiority of MSSA over state-of-the-art attention methods. The visualization analysis and ablation study are conducted to improve the explainability of MSSA in the decision-making process.
    CONCLUSIONS: Our proposed MSSANet utilized the opacity distribution characteristics of CC to enhance the representational power and explainability of deep convolutional neural network (CNN) and improve the CC classification performance. Our proposed method has the potential in the early clinical CC diagnosis.
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