Abstract

The IEEE International Conference on Software Architecture (ICSA) is the premier gathering of practitioners and researchers interested in software architecture, component-based software engineering, and quality aspects of complex software systems. The 21st IEEE International Conference on Software Architecture (ICSA 2024) continued the tradition of a working conference, where attendees met and where software architects were able to explain the challenges they face and try to influence the future of the field. Interactive working sessions were the place where researchers met practitioners to identify opportunities to shape the future of our field.

Abstract

Leishmania donovani causes a neglected tropical disease called visceral leishmaniasis. Additionally, leishmaniasis also manifests opportunistically, under conditions of immune compromise. The continued non-availability of effectively curative interventions (drugs or vaccines) against this disease necessitates a deeper knowledge of Leishmania biology in order to evolve novel strategies against the disease. We have used a meta-analysis approach to analyse Leishmania’s composite genetic network rather than investigating individual candidate genes. We performed Weighted Gene Co-expression Network Analysis (WGCNA) on publicly available Leishmania donovani transcriptome data to identify co-regulatory genetic modules. This clustering of Leishmania donovani transcriptomes revealed that genes fall in 30 distinct co-regulated modules with 32 to 3012 genes. In order to analyse the distribution of genes in Leishmania gene modules, we queried the enrichment or depletion of various annotation-qualifiers in the modules. We observed that several modules are specifically and individually enriched or depleted for annotation qualifiers derived from GO-annotation and KEGG-pathways and are differentially associated with life-phases and experimental conditions. Additionally, modules are also enriched or depleted for sequence based genetic features such as chromosomal location, location on co-transcriptional segment, rank of transcript from initiation of transcription, skewed usage of known RNA Binding Protein motifs. Classification of uncharacterized transcripts into co-regulatory modules provides insights in their probable characteristics, aiding future empirical investigation. Strikingly, two of the modules have reciprocal features including individual associations with logarithmic or stationary growth phases of Leishmania, two important life-phases that simulate the vector-dwelling pro-cyclic and the pre-infective meta-cyclic forms. Collectively, our analyses of Leishmania co-regulated gene modules is suggestive of additional regulatory modes over the mere differential mRNA stabilization.

Abstract

The efective management of brain tumors relies on precise typing, subtyping, and grading. We present the IPD-Brain Dataset, a crucial resource for the neuropathological community, comprising 547 high-resolution H&E stained slides from 367 patients for the study of glioma subtypes and immunohistochemical biomarkers. Scanned at 40x magnifcation, this dataset is one of the largest in Asia, specifcally focusing on the Indian demographics. It encompasses detailed clinical annotations, including patient age, sex, radiological fndings, diagnosis, CNS WHO grade, and IHC biomarker status (IDH1R132H, ATRX and TP53 along with proliferation index, Ki67), providing a rich foundation for research. The dataset is open for public access and is designed for various applications, from machine learning model training to the exploration of regional and ethnic disease variations. Preliminary validations utilizing Multiple Instance Learning for tasks such as glioma subtype classifcation and IHC biomarker identifcation underscore its potential to signifcantly contribute to global collaboration in brain tumor research, enhancing diagnostic precision and understanding of glioma variability across diferent populations.

Abstract

The pursuit of habit building is challenging, and most people struggle with it. Research on successful habit formation is mainly based on small human trials focusing on the same habit for all the participants as conducting long-term heterogonous habit studies can be logistically expensive. With the advent of self-help, there has been an increase in online communities and applications that are centered around habit building and logging. Habit building applications can provide large-scale data on real-world habit building attempts and unveil the commonalities among successful ones. We collect public data on stickk.com, which allows users to track progress on habit building attempts called commitments. A commitment can have an external referee, regular check-ins about the progress, and a monetary stake in case of failure. Our data consists of 742,923 users and 397,456 commitments. In addition to the dataset, rooted in theories like Fresh Start Effect, Accountablity, and Loss Aversion, we ask questions about how commitment properties like start date, external accountability, monitory stake, and pursuing multiple habits together affects the odds of success. We found that people tend to start habits on temporal landmarks, but that does not affect the probability of their success. Practices like accountability and stakes are not often used but are strong determents of success. Commitments of 6 to 8 weeks in length, weekly reporting with an external referee, and a monetary amount at stake tend to be most successful. Finally, around 40% of all commitments are attempted simultaneously with other goals. Simultaneous attempts of pursuing commitments may fail early, but if pursued through the initial phase, they are statistically more successful than building one habit at a time.

Abstract

The White House Executive Order on Artificial Intelligence highlights the risks of large language models (LLMs) empowering malicious actors in developing biological, cyber, and chemical weapons. To measure these risks of malicious use, government institutions and major AI labs are developing evaluations for hazardous capabilities in LLMs. However, current evaluations are private, preventing further research into mitigating risk. Furthermore, they focus on only a few, highly specific pathways for malicious use. To fill these gaps, we publicly release the Weapons of Mass Destruction Proxy (WMDP) benchmark, a dataset of 3,668 multiple-choice questions that serve as a proxy measurement of hazardous knowledge in biosecurity, cybersecurity, and chemical security. WMDP was developed by a consortium of academics and technical consultants, and was stringently filtered to eliminate sensitive information prior to public release. WMDP serves two roles: first, as an evaluation for hazardous knowledge in LLMs, and second, as a benchmark for unlearning methods to remove such hazardous knowledge. To guide progress on unlearning, we develop RMU, a state-of-the-art unlearning method based on controlling model representations. RMU reduces model performance on WMDP while maintaining general capabilities in areas such as biology and computer science, suggesting that unlearning may be a concrete path towards reducing malicious use from LLMs. We release our benchmark and code publicly at https://wmdp.ai

Abstract

Fake news being spread on social media platforms has a disruptive and damaging impact on our lives. Multimedia content improves the visibility of posts more than text data but is also being used for creating fake news. Previous multimodal works have tried to address the problem of modeling heterogeneous modalities in identifying fake news. However, these works have the following limitations: (1) inefficient encoding of inter-modal relations by utilizing a simple concatenation operator on the modalities at a later stage in a model, which might result in information loss; (2) training very deep neural networks with a disproportionate number of parameters on small multimodal datasets result in higher chances of overfitting. To address these limitations, we propose GAME-ON, a Graph Neural Network based end-to-end trainable framework that allows granular interactions within and across different modalities to learn more robust data representations for multimodal fake news detection. We use two publicly available fake news datasets, Twitter and Weibo, for evaluations. GAME-ON outperforms on Twitter by an average of 11% and achieves state-of-the-art performance on Weibo while using 91% fewer parameters than the best comparable state-of-the-art baseline. For deployment in real-world applications, GAME-ON can be used as a lightweight model (less memory and latency requirements), which makes it more feasible than previous state-of-the-art models.

Abstract

Chemical reaction prediction, encompassing forward synthesis and retrosynthesis, stands as a fundamental challenge in organic synthesis. A widely adopted computational approach frames synthesis prediction as a sequence-to-sequence translation task, using the common SMILES representation for molecules. Current evaluation of machine learning methods for retrosynthesis assume perfect training data, overlooking imperfections in reaction equations in popular datasets, such as missing reactants, products, other physical and practical constraints such as temperature and cost, primarily driven by a focus on the target molecule. This limitation leads to an incomplete representation of viable synthetic routes, especially when multiple sets of reactants can yield a given desired product. In response to these shortcomings, this study examines the prevailing evaluation methods and introduces comprehensive metrics designed to address imperfections in the dataset. Our novel metrics not only assess absolute accuracy by comparing predicted outputs with ground truth but also introduce a nuanced evaluation approach. We provide scores for partial correctness and compute adjusted accuracy through graph matching, acknowledging the inherent complexities of retrosynthetic pathways. Additionally, we explore the impact of small molecular augmentations while preserving chemical properties and employ similarity matching to enhance the assessment of prediction quality. We introduce SynFormer, a sequence-to-sequence model tailored for SMILES representation. It incorporates architectural enhancements to the original transformer, effectively tackling the challenges of chemical reaction prediction. SynFormer achieves a top-1 accuracy of 53.2% on the USPTO-50k dataset, demonstrating an improvement over previous state-of-the-art language models while being more efficient and eliminating the need for pre-training.

Abstract

Reinforcement learning (RL) has been applied to various domains in computational chemistry and has found wide-spread success. In this review, we first motivate the application of RL to chemistry and list some broad application domains, for example, molecule generation, geometry optimization, and retrosynthetic pathway search. We set up some of the formalism associated with reinforcement learning that should help the reader translate their chemistry problems into a form where RL can be used to solve them. We then discuss the solution formulations and algorithms proposed in recent literature for these problems, the advantages of one over the other, together with the necessary details of the RL algorithms they employ. This article should help the reader understand the state of RL applications in chemistry, learn about some relevant actively-researched open problems, gain insight into how RL can be used to approach them and hopefully inspire innovative RL applications in Chemistry.

Abstract

Hysteresis is a widely known and applied phenomenon whereas proteresis, it’s complimentary effect, has yet to be explored. A proteretic device is a bistable switch whose states depend on system’s future unlike hysteresis where the states depend on history. As a result, realization of this switch would be of great interest and may find vast applications. Therefore, the first contribution of this work is to model the proteretic phenomenon and implement in circuit theory. This model has been achieved by providing a constraint feedforward path to a hysteric feedback system and the circuit implementation was done using op-amps. As mentioned, the hysteresis and proteresis are two complementary phenomenon, hence, the second contribution of this work is to introduce “Prohys” a switch, the two corresponding states of which are hysteresis and proteresis. The switching between hysteresis and proteresis was achieved by varying the constraint feedforward path in proteretic device. It can also be achieved by adding a variable memory feedback system to the aforementioned device. We present the theoretical model, design, simulation and circuit implementation of the proposed switch using op-amps. The experimental results obtained from the circuit design match well with the theoretical models proposed.

Abstract

We introduce GPNN-CAM, a novel method for CNN explanation, that bridges two distinct areas of computer vision: Image Attribution, which aims to explain a predictor by highlighting image regions it finds important, and Single Image Generation (SIG), that focuses on learning how to generate variations of a single sample.GPNN-CAM leverages samples generated by Generative Patch Nearest Neighbors (GPNN) into a Class Activation Map (CAM) flavored attribution scheme. Our findings reveal that the incorporation of these samples yields remarkably effective results, enabling GPNN-CAM to demonstrate superior performance across multiple classifier architectures, and datasets.