味道是遵循社会趋势和行为的风味行业的焦点。新调味剂和分子的研究和开发在该领域至关重要。另一方面，自然风味的发展在现代社会中起着至关重要的作用。鉴于此，目前的工作提出了一个基于科学机器学习的新颖框架，以在风味工程和行业中解决新的问题。因此，这项工作带来了一种创新的方法来设计新的自然风味分子。评估了有关合成可及性，原子数以及与天然或伪天然产物的相似性的分子。

健壮的学习是科学机器学习（SCIML）的重要问题。文献中有几篇关于该主题的作品。但是，对方法的需求不断增加，可以同时考虑SCIML模型识别中涉及的所有不同不确定性组成部分。因此，这项工作提出了一种对SCIML的不确定性评估的综合方法，该方法还考虑了识别过程中涉及的几种不确定性来源。提出的方法中考虑的不确定性是缺乏理论和因果模型，对数据腐败或不完美的敏感性以及计算工作。因此，可以为SCIML领域中的不确定性感知模型提供总体策略。该方法通过案例研究验证，开发了用于聚合反应器的软传感器。结果表明，已识别的软传感器对于不确定性是可靠的，并以所提出的方法的一致性证实。

Recently, there has been an interest in improving the resources available in Intrusion Detection System (IDS) techniques. In this sense, several studies related to cybersecurity show that the environment invasions and information kidnapping are increasingly recurrent and complex. The criticality of the business involving operations in an environment using computing resources does not allow the vulnerability of the information. Cybersecurity has taken on a dimension within the universe of indispensable technology in corporations, and the prevention of risks of invasions into the environment is dealt with daily by Security teams. Thus, the main objective of the study was to investigate the Ensemble Learning technique using the Stacking method, supported by the Support Vector Machine (SVM) and k-Nearest Neighbour (kNN) algorithms aiming at an optimization of the results for DDoS attack detection. For this, the Intrusion Detection System concept was used with the application of the Data Mining and Machine Learning Orange tool to obtain better results

We describe a Physics-Informed Neural Network (PINN) that simulates the flow induced by the astronomical tide in a synthetic port channel, with dimensions based on the Santos - S\~ao Vicente - Bertioga Estuarine System. PINN models aim to combine the knowledge of physical systems and data-driven machine learning models. This is done by training a neural network to minimize the residuals of the governing equations in sample points. In this work, our flow is governed by the Navier-Stokes equations with some approximations. There are two main novelties in this paper. First, we design our model to assume that the flow is periodic in time, which is not feasible in conventional simulation methods. Second, we evaluate the benefit of resampling the function evaluation points during training, which has a near zero computational cost and has been verified to improve the final model, especially for small batch sizes. Finally, we discuss some limitations of the approximations used in the Navier-Stokes equations regarding the modeling of turbulence and how it interacts with PINNs.

In this work, we demonstrate the offline FPGA realization of both recurrent and feedforward neural network (NN)-based equalizers for nonlinearity compensation in coherent optical transmission systems. First, we present a realization pipeline showing the conversion of the models from Python libraries to the FPGA chip synthesis and implementation. Then, we review the main alternatives for the hardware implementation of nonlinear activation functions. The main results are divided into three parts: a performance comparison, an analysis of how activation functions are implemented, and a report on the complexity of the hardware. The performance in Q-factor is presented for the cases of bidirectional long-short-term memory coupled with convolutional NN (biLSTM + CNN) equalizer, CNN equalizer, and standard 1-StpS digital back-propagation (DBP) for the simulation and experiment propagation of a single channel dual-polarization (SC-DP) 16QAM at 34 GBd along 17x70km of LEAF. The biLSTM+CNN equalizer provides a similar result to DBP and a 1.7 dB Q-factor gain compared with the chromatic dispersion compensation baseline in the experimental dataset. After that, we assess the Q-factor and the impact of hardware utilization when approximating the activation functions of NN using Taylor series, piecewise linear, and look-up table (LUT) approximations. We also show how to mitigate the approximation errors with extra training and provide some insights into possible gradient problems in the LUT approximation. Finally, to evaluate the complexity of hardware implementation to achieve 400G throughput, fixed-point NN-based equalizers with approximated activation functions are developed and implemented in an FPGA.

Identifying anomalies has become one of the primary strategies towards security and protection procedures in computer networks. In this context, machine learning-based methods emerge as an elegant solution to identify such scenarios and learn irrelevant information so that a reduction in the identification time and possible gain in accuracy can be obtained. This paper proposes a novel feature selection approach called Finite Element Machines for Feature Selection (FEMa-FS), which uses the framework of finite elements to identify the most relevant information from a given dataset. Although FEMa-FS can be applied to any application domain, it has been evaluated in the context of anomaly detection in computer networks. The outcomes over two datasets showed promising results.

科学机器学习（SCIML）是对几个不同应用领域的兴趣越来越多的领域。在优化上下文中，基于SCIML的工具使得能够开发更有效的优化方法。但是，必须谨慎评估和执行实施优化的SCIML工具。这项工作提出了稳健性测试的推论，该测试通过表明其结果尊重通用近似值定理，从而确保了基于多物理的基于SCIML的优化的鲁棒性。该测试应用于一种新方法的框架，该方法在一系列基准测试中进行了评估，以说明其一致性。此外，将提出的方法论结果与可行优化的可行区域进行了比较，这需要更高的计算工作。因此，这项工作为保证在多目标优化中应用SCIML工具的稳健性测试提供了比存在的替代方案要低的计算努力。

使用机器学习算法从未标记的文本中提取知识可能很复杂。文档分类和信息检索是两个应用程序，可以从无监督的学习（例如文本聚类和主题建模）中受益，包括探索性数据分析。但是，无监督的学习范式提出了可重复性问题。初始化可能会导致可变性，具体取决于机器学习算法。此外，关于群集几何形状，扭曲可能会产生误导。在原因中，异常值和异常的存在可能是决定因素。尽管初始化和异常问题与文本群集和主题建模相关，但作者并未找到对它们的深入分析。这项调查提供了这些亚地区的系统文献综述（2011-2022），并提出了共同的术语，因为类似的程序具有不同的术语。作者描述了研究机会，趋势和开放问题。附录总结了与审查的作品直接或间接相关的文本矢量化，分解和聚类算法的理论背景。

这项工作使用来自建设性模拟的可靠数据比较了监督的机器学习方法，以估算空袭期间发射导弹的最有效时刻。我们采用了重采样技术来改善预测模型，分析准确性，精度，召回和F1得分。的确，我们可以根据决策树以及其他算法对重采样技术的显着敏感性来确定模型的显着性能。最佳F1分数的模型的值分别为0.379和0.465，而没有重新采样技术，这一值分别增加了22.69％。因此，如果理想，重新采样技术可以改善模型的召回率和F1得分，而准确性和精确度略有下降。因此，通过通过建设性模拟获得的数据，可以根据机器学习模型开发决策支持工具，从而可以提高BVR空中战斗的飞行质量，从而提高进攻任务的有效性以达到特定目标。

研究人员通常会采用数值方法来理解和预测海洋动力学，这是掌握环境现象的关键任务。在地形图很复杂，有关基础过程的知识不完整或应用程序至关重要的情况下，此类方法可能不适合。另一方面，如果观察到海洋动力学，则可以通过最近的机器学习方法来利用它们。在本文中，我们描述了一种数据驱动的方法，可以预测环境变量，例如巴西东南海岸的Santos-Sao Vicente-Bertioga estuarine系统的当前速度和海面高度。我们的模型通过连接最新的序列模型（LSTM和Transformers）以及关系模型（图神经网络）来利用时间和空间归纳偏见，以学习时间特征和空间特征，观察站点之间共享的关系。我们将结果与桑托斯运营预测系统（SOFS）进行比较。实验表明，我们的模型可以实现更好的结果，同时保持灵活性和很少的领域知识依赖性。