Chemical representation learning has gained increasing interest due to the limited availability of supervised data in fields such as drug and materials design. This interest particularly extends to chemical language representation learning, which involves pre-training Transformers on SMILES sequences - textual descriptors of molecules. Despite its success in molecular property prediction, current practices often lead to overfitting and limited scalability due to early convergence. In this paper, we introduce a novel chemical language representation learning framework, called MolTRES, to address these issues. MolTRES incorporates generator-discriminator training, allowing the model to learn from more challenging examples that require structural understanding. In addition, we enrich molecular representations by transferring knowledge from scientific literature by integrating external materials embedding. Experimental results show that our model outperforms existing state-of-the-art models on popular molecular property prediction tasks.

Pre-trained chemical language models (CLMs) excel in the field of molecular property prediction, utilizing string-based molecular descriptors such as SMILES for learning universal representations. However, such string-based descriptors implicitly contain limited structural information, which is closely associated with molecular property prediction. In this work, we introduce Moleco, a novel contrastive learning framework to enhance the understanding of molecular structures within CLMs. Based on the similarity of fingerprint vectors among different molecules, we train CLMs to distinguish structurally similar and dissimilar molecules in a contrastive manner. Experimental results demonstrate that Moleco significantly improves the molecular property prediction performance of CLMs, outperforming state-of-the-art models. Moreover, our in-depth analysis with diverse Moleco variants verifies that fingerprint vectors are highly effective features in improving CLMs’ understanding of the structural information of molecules.

Materials science is an interdisciplinary field focused on studying and discovering materials around us. However, due to the vast space of materials, datasets in this field are typically scarce and have limited coverage. This inherent limitation makes current adaptation methods less effective when adapting pre-trained language models (PLMs) to materials science, as these methods rely heavily on the frequency information from limited downstream datasets. In this paper, we propose Semantic Knowledge Transfer (SEED), a novel vocabulary expansion method to adapt the pre-trained language models for materials science. The core strategy of SEED is to transfer the materials knowledge of lightweight embeddings into the PLMs. To this end, we introduce knowledge bridge networks, which learn to transfer the latent knowledge of the materials embeddings into ones compatible with PLMs. By expanding the embedding layer of PLMs with these transformed embeddings, PLMs can comprehensively understand the complex terminology associated with materials science. We conduct extensive experiments across a broad range of materials-related benchmarks. Comprehensive evaluation results convincingly demonstrate that SEED mitigates the mentioned limitations of previous adaptation methods, showcasing the efficacy of transferring embedding knowledge into PLMs.

In this paper, we introduce COCONUT to effectively guide the contextualization of structured commonsense knowledge based on largelanguage models. COCONUT employs a contextualized knowledge prompting scheme to gather high-quality contextualization examplesfrom a large language model. These examples are subsequently distilled into small language models to enhance their contextualization capability. Extensive evaluations show that COCONUT considerably improves commonsense reasoning performance across diverse benchmarks, models, and settings, exhibiting its flexibility and universality in generating contextualized commonsense knowledge. Notably,COCONUT consistently outperforms the state-of-the-art technique by an average of 5.8%.

We introduce a novel continued pre-training method, MELT (MatEriaLs-aware continued pre-Training), specifically designed to efficiently adapt the pre-trained language models (PLMs) for materials science. Unlike previous adaptation strategies that solely focus on constructing domain-specific corpus, MELT comprehensively considers both the corpus and the training strategy, given that materials science corpus has distinct characteristics from other domains. To this end, we first construct a comprehensive materials knowledge base from the scientific corpus by building semantic graphs. Leveraging this extracted knowledge, we integrate a curriculum into the adaptation process that begins with familiar and generalized concepts and progressively moves toward more specialized terms. We conduct extensive experiments across diverse benchmarks to verify the effectiveness and generality of MELT. A comprehensive evaluation convincingly supports the strength of MELT, demonstrating superior performance compared to existing continued pre-training methods. In-depth analysis also shows that MELT enables PLMs to effectively represent materials entities compared to the existing adaptation methods, thereby highlighting its broad applicability across a wide spectrum of materials science.

Recent approaches to zero-shot commonsense reasoning have enabled Pre-trained Language Models (PLMs) to learn a broad range of commonsense knowledge without being tailored to specific situations. However, they often suffer from human reporting bias inherent in textual commonsense knowledge, leading to discrepancies in understanding between PLMs and humans. In this work, we aim to bridge this gap by introducing an additional information channel to PLMs. We propose Imagine (Machine Imagination-based Reasoning), a novel zero-shot commonsense reasoning framework designed to complement textual inputs with visual signals derived from machine-generated images. To achieve this, we enhance PLMs with imagination capabilities by incorporating an image generator into the reasoning process. To guide PLMs in effectively leveraging machine imagination, we create a synthetic pre-training dataset that simulates visual question-answering. Our extensive experiments on diverse reasoning benchmarks and analysis show that Imagine outperforms existing methods by a large margin, highlighting the strength of machine imagination in mitigating reporting bias and enhancing generalization capabilities.

Despite the versatility of pre-trained language models (PLMs) across domains, their large memory footprints pose significant challenges in federated learning (FL), where the training model has to be distributed between a server and clients. One potential solution to bypass such constraints might be the use of parameter-efficient fine-tuning (PEFT) in the context of FL. However, we have observed that typical PEFT tends to severely suffer from heterogeneity among clients in FL scenarios, resulting in unstable and slow convergence. In this paper, we propose Client-Customized Adaptation (C2A), a novel hypernetwork-based FL framework that generates client-specific adapters by conditioning the client information. With the effectiveness of the hypernetworks in generating customized weights through learning to adopt the different characteristics of inputs, C2A can maximize the utility of shared model parameters while minimizing the divergence caused by client heterogeneity. To verify the efficacy of C2A, we perform extensive evaluations on FL scenarios involving heterogeneity in label and language distributions. Comprehensive evaluation results clearly support the superiority of C2A in terms of both efficiency and effectiveness in FL scenarios.

Towards human-level visual understanding, visual commonsense generation has been introduced to generate commonsense inferences beyond images. However, current research on visual commonsense generation has overlooked an important human cognitive ability: generating descriptive and diverse inferences. In this work, we propose a novel visual commonsense generation framework, called DIVE, which aims to improve the descriptiveness and diversity of generated inferences. DIVE involves two methods, generic inference filtering and contrastive retrieval learning, which address the limitations of existing visual commonsense resources and training objectives. Experimental results verify that DIVE outperforms state-of-the-art models for visual commonsense generation in terms of both descriptiveness and diversity, while showing a superior quality in generating unique and novel inferences. Notably, DIVE achieves human-level descriptiveness and diversity on Visual Commonsense Graphs. Furthermore, human evaluations confirm that DIVE aligns closely with human judgments on descriptiveness and diversity.

Prompt tuning has emerged as a successful parameter-efficient alternative to the full fine-tuning of language models. However, prior works on prompt tuning often utilize long soft prompts of up to 100 tokens to improve performance, overlooking the inefficiency associated with extended inputs. In this paper, we propose a novel prompt tuning method SMoP (Sparse Mixture-of-Prompts) that utilizes short soft prompts for efficient training and inference while maintaining performance gains typically induced from longer soft prompts. To achieve this, SMoP employs a gating mechanism to train multiple short soft prompts specialized in handling different subsets of the data, providing an alternative to relying on a single long soft prompt to cover the entire data. Experimental results demonstrate that SMoP outperforms baseline methods while reducing training and inference costs. We release our code at https://github.com/jyjohnchoi/SMoP.

Computational inefficiency in transformers has been a long-standing challenge, hindering the deployment in resource-constrained or real-time applications. One promising approach to mitigate this limitation is to progressively remove less significant tokens, given that the sequence length strongly contributes to the inefficiency. However, this approach entails a potential risk of losing crucial information due to the irrevocable nature of token removal. In this paper, we introduce Leap-of-Thought (LoT), a novel token reduction approach that dynamically routes tokens within layers. Unlike previous work that irrevocably discards tokens, LoT enables tokens to ‘leap’ across layers. This ensures that all tokens remain accessible in subsequent layers while reducing the number of tokens processed within layers. We achieve this by pairing the transformer with dynamic token routers, which learn to selectively process tokens essential for the task. Evaluation results clearly show that LoT achieves a substantial improvement in computational efficiency. Specifically, LoT attains up to 25x faster inference time without a significant loss in accuracy

We introduce Basic, Tiniest Subword (BTS) units for the Korean language, which are inspired by the invention principle of Hangeul, the Korean writing system. Instead of relying on 51 Korean consonant and vowel letters, we form the letters from BTS units by adding strokes or combining them. To examine the impact of BTS units on Korean language processing, we develop a novel BTS-based word embedding framework that is readily applicable to various models. Our experiments reveal that BTS units significantly improve the performance of Korean word embedding on all intrinsic and extrinsic tasks in our evaluation. In particular, BTS-based word embedding outperforms the state-of-theart Korean word embedding by 11.8% in word analogy. We further investigate the unique advantages provided by BTS units through indepth analysis.

Pre-trained language models have achieved remarkable successes in natural language processing tasks, coming at the cost of increasing model size. To address this issue, knowledge distillation (KD) has been widely applied to compress language models. However, typical KD approaches for language models have overlooked the difficulty of training examples, suffering from incorrect teacher prediction transfer and sub-efficient training. In this paper, we propose a novel KD framework, Tutor-KD, which improves the distillation effectiveness by controlling the difficulty of training examples during pre-training. We introduce a tutor network that generates samples that are easy for the teacher but difficult for the student, with training on a carefully designed policy gradient method. Experimental results show that Tutor-KD significantly and consistently outperforms the state-of-the-art KD methods with variously sized student models on the GLUE benchmark, demonstrating that the tutor can effectively generate training examples for the student.

Self-supervised pre-training has achieved remarkable success in extensive natural language processing tasks. Masked language modeling (MLM) has been widely used for pre-training effective bidirectional representations but comes at a substantial training cost. In this paper, we propose a novel concept-based curriculum masking (CCM) method to efficiently pre-train a language model. CCM has two key differences from existing curriculum learning approaches to effectively reflect the nature of MLM. First, we introduce a novel curriculum that evaluates the MLM difficulty of each token based on a carefully-designed linguistic difficulty criterion. Second, we construct a curriculum that masks easy words and phrases first and gradually masks related ones to the previously masked ones based on a knowledge graph. Experimental results show that CCM significantly improves pre-training efficiency. Specifically, the model trained with CCM shows comparative performance with the original BERT on the General Language Understanding Evaluation benchmark at half of the training cost.

Commonsense inference poses a unique challenge to reason and generate the physical, social, and causal conditions of a given event. Existing approaches to commonsense inference utilize commonsense transformers, which are large-scale language models that learn commonsense knowledge graphs. However, they suffer from a lack of coverage and expressive diversity of the graphs, resulting in a degradation of the representation quality. In this paper, we focus on addressing missing relations in commonsense knowledge graphs, and propose a novel contrastive learning framework called SOLAR. Our framework contrasts sets of semantically similar and dissimilar events, learning richer inferential knowledge compared to existing approaches. Empirical results demonstrate the efficacy of SOLAR in commonsense inference of diverse commonsense knowledge graphs. Specifically, SOLAR outperforms the state-of-the-art commonsense transformer on commonsense inference with ConceptNet by 1.84% on average among 8 automatic evaluation metrics. In-depth analysis of SOLAR sheds light on the effects of the missing relations utilized in learning commonsense knowledge graphs.

Warning: This manuscript contains a certain level of offensive expression. As communication through social media platforms has grown immensely, the increasing prevalence of offensive language online has become a critical problem. Notably in Korea, one of the countries with the highest Internet usage, automatic detection of offensive expressions has recently been brought to attention. However, morphological richness and complex syntax of Korean causes difficulties in neural model training. Furthermore, most of previous studies mainly focus on the detection of abusive language, disregarding implicit offensiveness and underestimating a different degree of intensity. To tackle these problems, we present KOAS, a system that fully exploits both contextual and linguistic features and estimates an offensiveness score for a text. We carefully designed KOAS with a multi-task learning framework and constructed a Korean dataset for offensive analysis from various domains. Refer for a detailed demonstration.

Deep neural network-based pretraining methods have achieved impressive results in many natural language processing tasks including text classification. However, their applicability to large-scale text classification with numerous categories (e.g., several thousands) is yet to be well-studied, where the training data is insufficient and skewed in terms of categories. In addition, existing pretraining methods usually involve excessive computation and memory overheads. In this paper, we develop a novel multi-pretraining framework for large-scale text classification. This multi-pretraining framework includes both a self-supervised pretraining and a weakly supervised pretraining. We newly introduce an out-of-context words detection task on the unlabeled data as the self-supervised pretraining. It captures the topic-consistency of words used in sentences, which is proven to be useful for text classification. In addition, we propose a weakly supervised pretraining, where labels for text classification are obtained automatically from an existing approach. Experimental results clearly show that both pretraining approaches are effective for large-scale text classification task. The proposed scheme exhibits significant improvements as much as 3.8% in terms of macro-averaging F1-score over strong pretraining methods, while being computationally efficient.

In this paper, we present an adaptive convolution for text classification to give flexibility to convolutional neural networks (CNNs). Unlike traditional convolutions which utilize the same set of filters regardless of different inputs, the adaptive convolution employs adaptively generated convolutional filters conditioned on inputs. We achieve this by attaching filter-generating networks, which are carefully designed to generate input-specific filters, to convolution blocks in existing CNNs. We show the efficacy of our approach in existing CNNs based on the performance evaluation. Our evaluation indicates that all of our baselines achieve performance improvements with adaptive convolutions as much as up to 2.6 percentage point in seven benchmark text classification datasets.