Attention mechanisms have seen wide adoption in neural NLP models. In addition to improving predictive performance, these are often touted as affording transparency: models equipped with attention provide a distribution over attended-to input units, and this is often presented (at least implicitly) as communicating the relative importance of inputs. However, it is unclear what relationship exists between attention weights and model outputs. In this work we perform extensive experiments across a variety of NLP tasks that aim to assess the degree to which attention weights provide meaningful "explanations" for predictions. We find that they largely do not. For example, learned attention weights are frequently uncorrelated with gradient-based measures of feature importance, and one can identify very different attention distributions that nonetheless yield equivalent predictions. Our findings show that standard attention modules do not provide meaningful explanations and should not be treated as though they do. Code to reproduce all experiments is available at https://github.com/successar/ AttentionExplanation.

Multiple studies have focused on predicting the prospective popularity of an online document as a whole, without paying attention to the contributions of its individual parts. We introduce the task of proactively forecasting popularities of sentences within online news documents solely utilizing their natural language content. We model sentence-specific popularity forecasting as a sequence regression task. For training our models, we curate InfoPop, the first dataset containing popularity labels for over 1.7 million sentences from over 50,000 online news documents. To the best of our knowledge, this is the first dataset automatically created using streams of incoming search engine queries to generate sentence-level popularity annotations. We propose a novel transfer learning approach involving sentence salience prediction as an auxiliary task. Our proposed technique coupled with a BERT-based neural model exceeds nDCG values of 0.8 for proactive sentence-specific popularity forecasting. Notably, our study presents a non-trivial takeaway: though popularity and salience are different concepts, transfer learning from salience prediction enhances popularity forecasting. We release InfoPop and make our code publicly available: https://github.com/sayarghoshroy/InfoPopularity

Mixup is a popular data augmentation technique for training deep neural networks where additional samples are generated by linearly interpolating pairs of inputs and their labels. This technique is known to improve the generalization performance in many learning paradigms and applications. In this work, we first analyze Mixup and show that it implicitly regularizes infinitely many directional derivatives of all orders. We then propose a new method to improve Mixup based on the novel insight. To demonstrate the effectiveness of the proposed method, we conduct experiments across various domains such as images, tabular data, speech, and graphs. Our results show that the proposed method improves Mixup across various datasets using a variety of architectures, for instance, exhibiting an improvement over Mixup by 0.8% in ImageNet top-1 accuracy.

Speech systems are sensitive to accent variations. This is especially challenging in the Indian context, with an abundance of languages but a dearth of linguistic studies characterising pronunciation variations. The growing number of L2 English speakers in India reinforces the need to study accents and L1-L2 interactions. We investigate the accents of Indian English (IE) speakers and report in detail our observations, both specific and common to all regions. In particular, we observe the phonemic variations and phonotactics occurring in the speakers' native languages and apply this to their English pronunciations. We demonstrate the influence of 18 Indian languages on IE by comparing the native language pronunciations with IE pronunciations obtained jointly from existing literature studies and phonetically annotated speech of 80 speakers. Consequently, we are able to validate the intuitions of Indian language influences on IE pronunciations by justifying pronunciation rules from the perspective of Indian language phonology. We obtain a comprehensive description in terms of universal and region-specific characteristics of IE, which facilitates accent conversion and adaptation of existing ASR and TTS systems to different Indian accents.

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.

In molecular research, simulation \& design of molecules are key areas with significant implications for drug development, material science, and other fields. Current classical computational power falls inadequate to simulate any more than small molecules, let alone protein chains on hundreds of peptide. Therefore these experiment are done physically in wet-lab, but it takes a lot of time \& not possible to examine every molecule due to the size of the search area, tens of billions of dollars are spent every year in these research experiments. Molecule simulation \& design has lately advanced significantly by machine learning models, A fresh perspective on the issue of chemical synthesis is provided by deep generative models for graph-structured data. By optimising differentiable models that produce molecular graphs directly, it is feasible to avoid costly search techniques in the discrete and huge space of chemical structures. But these models also suffer from computational limitations when dimensions become huge and consume huge amount of resources. Quantum Generative machine learning in recent years have shown some empirical results promising significant advantages over classical counterparts.

Developing and least developed countries face the dire challenge of ensuring that each child in their country receives required doses of vaccination, adequate nutrition and proper medication. International agencies such as UNICEF, WHO and WFP, among other organizations, strive to find innovative solutions to determine which child has received the benefits and which have not. Biometric recognition systems have been sought out to help solve this problem. To that end, this report establishes a baseline accuracy of a commercial contactless palmprint recognition system that may be deployed for recognizing children in the age group of one to five years old. On a database of contactless palmprint images of one thousand unique palms from 500 children, we establish SOTA authentication accuracy of 90.85% @ FAR of 0.01%, rank-1 identification accuracy of 99.0% (closed set), and FPIR=0.01 @ FNIR=0.3 for open-set identification using PalmMobile SDK from Armatura.

Selective classification involves identifying the subset of test samples that a model can classify with high accuracy, and is important for applications such as automated medical diagnosis. We argue that this capability of identifying uncertain samples is valuable for training classifiers as well, with the aim of building more accurate classifiers. We unify these dual roles by training a single auxiliary meta-network to output an importance weight as a function of the instance. This measure is used at train time to reweight training data, and at test-time to rank test instances for selective classification. A second, key component of our proposal is the meta-objective of minimizing dropout variance (the variance of classifier output when subjected to random weight dropout) for training the metanetwork. We train the classifier together with its metanetwork using a nested objective of minimizing classifier loss on training data and meta-loss on a separate meta-training dataset. We outperform current state-of-the-art on selective classification by substantial margins--for instance, upto 1.9% AUC and 2% accuracy on a real-world diabetic retinopathy dataset. Finally, our meta-learning framework extends naturally to unsupervised domain adaptation, given our unsupervised variance minimization meta-objective. We show cumulative absolute gains of 3.4% / 3.3% accuracy and AUC over the other baselines in domain shift settings on the Retinopathy dataset using unsupervised domain adaptation.

Many real-world learning scenarios face the challenge of slow concept drift, where data distributions change gradually over time. In this setting, we pose the problem of learning temporally sensitive importance weights for training data, in order to optimize predictive accuracy. We propose a class of temporal reweighting functions that can capture multiple timescales of change in the data, as well as instance-specific characteristics. We formulate a bi-level optimization criterion, and an associated meta-learning algorithm, by which these weights can be learned. In particular, our formulation trains an auxiliary network to output weights as a function of training instances, thereby compactly representing the instance weights. We validate our temporal reweighting scheme on a large real-world dataset of 39M images spread over a 9 year period. Our extensive experiments demonstrate the necessity of instance-based temporal reweighting in the dataset, and achieve significant improvements to classical batch-learning approaches. Further, our proposal easily generalizes to a streaming setting and shows significant gains compared to recent continual learning methods.

Intelligently extracting and linking complex scientific information from unstructured text is a challenging endeavor particularly for those inexperienced with natural language processing. Here, we present a simple sequence-to-sequence approach to joint named entity recognition and relation extraction for complex hierarchical information in scientific text. The approach leverages a pre-trained large language model (LLM), GPT-3, that is fine-tuned on approximately 500 pairs of prompts (inputs) and completions (outputs). Information is extracted either from single sentences or across sentences in abstracts/passages, and the output can be returned as simple English sentences or a more structured format, such as a list of JSON objects. We demonstrate that LLMs trained in this way are capable of accurately extracting useful records of complex scientific knowledge for three representative tasks in materials chemistry: linking dopants with their host materials, cataloging metal-organic frameworks, and general chemistry/phase/morphology/application information extraction. This approach represents a simple, accessible, and highly-flexible route to obtaining large databases of structured knowledge extracted from unstructured text. An online demo is available at http://www.matscholar.com/info-extraction.