相关论文: Toxicity Prediction using Deep Learning

Deep neural networks usually require large labeled datasets for training to achieve state-of-the-art performance in many tasks, such as image classification and natural language processing. Although a lot of data is created each day by…

The paper examines the potential of deep learning to support decisions in financial risk management. We develop a deep learning model for predicting whether individual spread traders secure profits from future trades. This task embodies…

Machine Learning is a powerful tool to reveal and exploit correlations in a multi-dimensional parameter space. Making predictions from such correlations is a highly non-trivial task, in particular when the details of the underlying dynamics…

Skin cancer is one of the most prevalent and deadly forms of cancer worldwide, highlighting the critical importance of early detection and diagnosis in improving patient outcomes. Deep learning (DL) has shown significant promise in…

Deep neural networks have outperformed existing machine learning models in various molecular applications. In practical applications, it is still difficult to make confident decisions because of the uncertainty in predictions arisen from…

The field of high-energy physics (HEP), along with many scientific disciplines, is currently experiencing a dramatic influx of new methodologies powered by modern machine learning techniques. Over the last few years, a growing body of HEP…

In the deep-learning community new algorithms are published at an incredible pace. Therefore, solving an image classification problem for new datasets becomes a challenging task, as it requires to re-evaluate published algorithms and their…

Deep neural networks are proven to be vulnerable to data poisoning attacks. Recently, a specific type of data poisoning attack known as availability attacks has led to the failure of data utilization for model learning by adding…

The arc of drug discovery entails a multiparameter optimization problem spanning vast length scales. They key parameters range from solubility (angstroms) to protein-ligand binding (nanometers) to in vivo toxicity (meters). Through feature…

Predicitions made by neural networks can be fraudulently altered by so-called poisoning attacks. A special case are backdoor poisoning attacks. We study suitable detection methods and introduce a new method called Heatmap Clustering. There,…

Testing deep learning-based systems is crucial but challenging due to the required time and labor for labeling collected raw data. To alleviate the labeling effort, multiple test selection methods have been proposed where only a subset of…

Understanding toxicity in user conversations is undoubtedly an important problem. Addressing "covert" or implicit cases of toxicity is particularly hard and requires context. Very few previous studies have analysed the influence of…

The unwavering success of deep learning in the past decade led to the increasing prevalence of deep learning methods in various application fields. However, the downsides of deep learning, most prominently its lack of trustworthiness, may…

Thermoelectric materials can be used to construct devices which recycle waste heat into electricity. However, the best known thermoelectrics are based on rare, expensive or even toxic elements, which limits their widespread adoption. To…

Biased associations have been a challenge in the development of classifiers for detecting toxic language, hindering both fairness and accuracy. As potential solutions, we investigate recently introduced debiasing methods for text…

Deep learning has become a powerful tool in computational biology, revolutionising the analysis and interpretation of biological data over time. In our article review, we delve into various aspects of deep learning in computational biology.…

As machine learning (ML) classifiers increasingly oversee the automated monitoring of network traffic, studying their resilience against adversarial attacks becomes critical. This paper focuses on poisoning attacks, specifically backdoor…

Blood glucose simulation allows the effectiveness of type 1 diabetes (T1D) management strategies to be evaluated without patient harm. Deep learning algorithms provide a promising avenue for extending simulator capabilities; however, these…

As one kind of distributed machine learning technique, federated learning enables multiple clients to build a model across decentralized data collaboratively without explicitly aggregating the data. Due to its ability to break data silos,…

Machine learning has made important headway in helping to improve the treatment of quantum many-body systems. A domain of particular relevance are correlated inhomogeneous systems. What has been missing so far is a general, scalable…