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Generative molecular models generate novel molecules with desired properties by searching chemical space. Traditional combinatorial optimization methods, such as genetic algorithms, have demonstrated superior performance in various molecular optimization tasks. However, these methods do not utilize docking simulation to inform the design process, and heavy dependence on the quality and quantity of available data, as well as require additional structural optimization to become candidate drugs. To address this limitation, we propose a novel model named DockingGA that combines Transformer neural networks and genetic algorithms to generate molecules with better binding affinity for specific targets. In order to generate high quality molecules, we chose the Self-referencing Chemical Structure Strings to represent the molecule and optimize the binding affinity of the molecules to different targets. Compared to other baseline models, DockingGA proves to be the optimal model in all docking results for the top 1, 10 and 100 molecules, while maintaining 100% novelty. Furthermore, the distribution of physicochemical properties demonstrates the ability of DockingGA to generate molecules with favorable and appropriate properties. This innovation creates new opportunities for the application of generative models in practical drug discovery. [ABSTRACT FROM AUTHOR]

In the context of the accelerated pace of daily life and the development of e-commerce, online shopping is a mainstream way for consumers to access products and services. To understand their emotional expressions in facing different shopping experience scenarios, this paper presents a sentiment analysis method that combines the e-commerce review keyword-generated image with a hybrid machine learning-based model, in which the Word2Vec-TextRank is used to extract keywords that act as the inputs for generating the related images by generative Artificial Intelligence (AI). Subsequently, a hybrid Convolutional Neural Network and Support Vector Machine (CNN-SVM) model is applied for sentiment classification of those keyword-generated images. For method validation, the data randomly comprised of 5000 reviews from Amazon have been analyzed. With superior keyword extraction capability, the proposed method achieves impressive results on sentiment classification with a remarkable accuracy of up to 97.13%. Such performance demonstrates its advantages by using the text-to-image approach, providing a unique perspective for sentiment analysis in the e-commerce review data compared to the existing works. Thus, the proposed method enhances the reliability and insights of customer feedback surveys, which would also establish a novel direction in similar cases, such as social media monitoring and market trend research. [ABSTRACT FROM AUTHOR]