Graph neural networks (GNNs) have received remarkable success in link prediction (GNNLP) tasks. Existing efforts first predefine the subgraph for the whole dataset and then apply GNNs to encode edge representations by leveraging the neighborhood structure induced by the fixed subgraph. The prominence of GNNLP methods significantly relies on the adhoc subgraph. Since node connectivity in real-world graphs is complex, one shared subgraph is limited for all edges. Thus, the choices of subgraphs should be personalized to different edges. However, performing personalized subgraph selection is nontrivial since the potential selection space grows exponentially to the scale of edges. Besides, the inference edges are not available during training in link prediction scenarios, so the selection process needs to be inductive. To bridge the gap, we introduce a Personalized Subgraph Selector (PS2) as a plug-and-play framework to automatically, personally, and inductively identify optimal subgraphs for different edges when performing GNNLP. PS2 is instantiated as a bi-level optimization problem that can be efficiently solved differently. Coupling GNNLP models with PS2, we suggest a brand-new angle towards GNNLP training: by first identifying the optimal subgraphs for edges; and then focusing on training the inference model by using the sampled subgraphs. Comprehensive experiments endorse the effectiveness of our proposed method across various GNNLP backbones (GCN, GraphSage, NGCF, LightGCN, and SEAL) and diverse benchmarks (Planetoid, OGB, and Recommendation datasets). Our code is publicly available at \url{https://github.com/qiaoyu-tan/PS2}

Machine learning methods have been used to accelerate the molecule optimization process. However, efficient search for optimized molecules satisfying several properties with scarce labeled data remains a challenge for machine learning molecule optimization. In this study, we propose MOMO, a multi-objective molecule optimization framework to address the challenge by combining learning of chemical knowledge with Pareto-based multi-objective evolutionary search. To learn chemistry, it employs a self-supervised codec to construct an implicit chemical space and acquire the continues representation of molecules. To explore the established chemical space, MOMO uses multi-objective evolution to comprehensively and efficiently search for similar molecules with multiple desirable properties. We demonstrate the high performance of MOMO on four multi-objective property and similarity optimization tasks, and illustrate the search capability of MOMO through case studies. Remarkably, our approach significantly outperforms previous approaches in optimizing three objectives simultaneously. The results show the optimization capability of MOMO, suggesting to improve the success rate of lead molecule optimization.

The number of international benchmarking competitions is steadily increasing in various fields of machine learning (ML) research and practice. So far, however, little is known about the common practice as well as bottlenecks faced by the community in tackling the research questions posed. To shed light on the status quo of algorithm development in the specific field of biomedical imaging analysis, we designed an international survey that was issued to all participants of challenges conducted in conjunction with the IEEE ISBI 2021 and MICCAI 2021 conferences (80 competitions in total). The survey covered participants' expertise and working environments, their chosen strategies, as well as algorithm characteristics. A median of 72% challenge participants took part in the survey. According to our results, knowledge exchange was the primary incentive (70%) for participation, while the reception of prize money played only a minor role (16%). While a median of 80 working hours was spent on method development, a large portion of participants stated that they did not have enough time for method development (32%). 25% perceived the infrastructure to be a bottleneck. Overall, 94% of all solutions were deep learning-based. Of these, 84% were based on standard architectures. 43% of the respondents reported that the data samples (e.g., images) were too large to be processed at once. This was most commonly addressed by patch-based training (69%), downsampling (37%), and solving 3D analysis tasks as a series of 2D tasks. K-fold cross-validation on the training set was performed by only 37% of the participants and only 50% of the participants performed ensembling based on multiple identical models (61%) or heterogeneous models (39%). 48% of the respondents applied postprocessing steps.

Recently, Neural architecture search has achieved great success on classification tasks for mobile devices. The backbone network for object detection is usually obtained on the image classification task. However, the architecture which is searched through the classification task is sub-optimal because of the gap between the task of image and object detection. As while work focuses on backbone network architecture search for mobile device object detection is limited, mainly because the backbone always requires expensive ImageNet pre-training. Accordingly, it is necessary to study the approach of network architecture search for mobile device object detection without expensive pre-training. In this work, we propose a mobile object detection backbone network architecture search algorithm which is a kind of evolutionary optimized method based on non-dominated sorting for NAS scenarios. It can quickly search to obtain the backbone network architecture within certain constraints. It better solves the problem of suboptimal linear combination accuracy and computational cost. The proposed approach can search the backbone networks with different depths, widths, or expansion sizes via a technique of weight mapping, making it possible to use NAS for mobile devices detection tasks a lot more efficiently. In our experiments, we verify the effectiveness of the proposed approach on YoloX-Lite, a lightweight version of the target detection framework. Under similar computational complexity, the accuracy of the backbone network architecture we search for is 2.0% mAP higher than MobileDet. Our improved backbone network can reduce the computational effort while improving the accuracy of the object detection network. To prove its effectiveness, a series of ablation studies have been carried out and the working mechanism has been analyzed in detail.

车辆到设施通信技术的最新进展使自动驾驶汽车能够共享感官信息以获得更好的感知性能。随着自动驾驶汽车和智能基础设施的快速增长，V2X感知系统将很快在大规模部署，这引发了一个关键的问题：我们如何在现实世界部署之前在挑战性的交通情况下评估和改善其性能？收集多样化的大型现实世界测试场景似乎是最简单的解决方案，但昂贵且耗时，而且收藏量只能涵盖有限的情况。为此，我们提出了第一个开放的对抗场景生成器V2XP-ASG，该发电机可以为现代基于激光雷达的多代理感知系统产生现实，具有挑战性的场景。 V2XP-ASG学会了构建对抗性协作图，并以对抗性和合理的方式同时扰动多个代理的姿势。该实验表明，V2XP-ASG可以有效地确定各种V2X感知系统的具有挑战性的场景。同时，通过对有限数量的挑战场景进行培训，V2X感知系统的准确性可以进一步提高12.3％，而正常场景的准确性可以进一步提高4％。

非视线（NLOS）成像是一种用于检测障碍物或角落周围物体的物体的新兴技术。关于被动NLOS的最新研究主要集中在稳态测量和重建方法上，这些方法显示出识别移动目标的局限性。据我们所知，我们提出了一种新颖的基于事件的无源NLOS成像方法。我们获得了基于事件的异步数据，其中包含NLOS目标的详细动态信息，并有效缓解由运动引起的斑点降解。此外，我们创建了第一个基于事件的NLOS成像数据集NLOS-ES，并且由时间表面表示提取基于事件的功能。我们通过基于事件的数据与基于框架的数据比较重建。基于事件的方法在PSNR和LPIP上表现良好，该方法比基于框架的方法好20％和10％，而数据量仅占传统方法的2％。

对于哈密顿系统，这项工作考虑了由符号演化图产生的位置（Q）和动量（P）变量的学习和预测。与Chen＆Tao（2021）相似，符号图由生成函数表示。此外，我们通过将时间序列（q_i，p_i）分为几个分区来开发新的学习方案，然后训练leap-frog神经网络（LFNN）以近似第一个（即初始条件）和一个之间的生成函数其余的分区。为了预测短时间内的系统演变，LFNN可以有效避免累积错误的问题。然后，将LFNN应用于更长的时间段内2：3谐振Kuiper带对象的行为，并且在我们以前的工作中构建的神经网络有两个重大改进（Li等人，2022年）：（（（ 1）雅各比积分的保护； （2）高度准确的轨道演化预测。我们建议LFNN可能有助于预测哈密顿系统的长时间演变。

在这项工作中，我们提出了一个新颖的观点，以解决贴片正确性评估的问题：正确的贴片实现了“答案”对越野车行为提出的问题的变化。具体而言，我们将贴片正确性评估变成一个问题回答问题。为了解决这个问题，我们的直觉是，自然语言处理可以提供必要的表示和模型来评估错误（问题）和补丁（答案）之间的语义相关性。具体而言，我们认为是输入错误报告以及生成的补丁的自然语言描述。我们的方法，Quatrain，首先考虑了最先进的消息生成模型，以生成与每个生成的补丁相关的相关输入。然后，我们利用神经网络体系结构来学习错误报告和提交消息之间的语义相关性。针对三个错误数据集生成的9135个补丁的大数据集（缺陷4J，Bugs.s.s.jar和Bears）的实验表明，Quatrain可以在预测补丁的正确性时达到0.886的AUC，并在过滤62％的62％错误的补丁时召回93％正确的补丁。我们的实验结果进一步证明了投入质量对预测性能的影响。我们进一步执行实验，以强调该模型确实了解了错误报告与预测的代码更改描述之间的关系。最后，我们与先前的工作进行比较，并讨论我们方法的好处。

由于复杂的注意机制和模型设计，大多数现有的视觉变压器（VIT）无法在现实的工业部署方案中的卷积神经网络（CNN）高效，例如张力和coreml。这提出了一个独特的挑战：可以设计视觉神经网络以与CNN一样快地推断并表现强大吗？最近的作品试图设计CNN-Transformer混合体系结构来解决这个问题，但是这些作品的整体性能远非令人满意。为了结束这些结束，我们提出了下一代视觉变压器，以在现实的工业场景中有效部署，即下一步，从延迟/准确性权衡的角度来看，它在CNN和VIT上占主导地位。在这项工作中，下一个卷积块（NCB）和下一个变压器块（NTB）分别开发出用于使用部署友好机制捕获本地和全球信息。然后，下一个混合策略（NHS）旨在将NCB和NTB堆叠在有效的混合范式中，从而提高了各种下游任务中的性能。广泛的实验表明，在各种视觉任务方面的延迟/准确性权衡方面，下一个VIT明显优于现有的CNN，VIT和CNN转换混合体系结构。在Tensorrt上，在可可检测上，Next-Vit超过5.4 MAP（从40.4到45.8），在类似延迟下，ADE20K细分的8.2％MIOU（从38.8％到47.0％）。同时，它可以与CSWIN达到可比的性能，而推理速度则以3.6倍的速度加速。在COREML上，在类似的延迟下，在COCO检测上，下一步超过了可可检测的4.6 MAP（从42.6到47.2），ADE20K分割的3.5％MIOU（从45.2％到48.7％）。代码将最近发布。

有望在近期量子计算机上建立有价值的应用程序。但是，最近的作品指出，VQA的性能极大地依赖于Ansatzes的表现性，并且受到优化问题（例如贫瘠的高原（即消失的梯度））的严重限制。这项工作提出了国家有效的ANSATZ（SEA），以改善训练性，以进行准确的基态制备。我们表明，海洋可以产生一个任意纯状态，其参数比通用的安萨兹少得多，从而使其适合基态估计等任务有效。然后，我们证明可以通过灵活地调节海洋的纠缠能力来有效地通过海洋有效地减轻贫瘠的高原，并可以最大程度地提高训练性。最后，我们研究了大量的示例，在基础状态估计中，我们在成本梯度和收敛速度的幅度上得到了显着改善。