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Optimization · Non-Convex

Bo Zhao, Robert M. Gower, Robin Walters, Rose Yu

In many neural networks, different values of the parameters may result in the same loss value. Parameter space symmetries are loss-invariant transformations that change the model parameters. Teleportation applies such transformations to accelerate optimization. However, the exact mechanism behind this algorithm's success is not well understood. In this paper, we show that teleportation not only speeds up optimization in the short-term, but gives overall faster time to convergence. Additionally, teleporting to minima with different curvatures improves generalization, which suggests a connection between the curvature of the minimum and generalization ability. Finally, we show that integrating teleportation into a wide range of optimization algorithms and optimization-based meta-learning improves convergence. Our results showcase the versatility of teleportation and demonstrate the potential of incorporating symmetry in optimization.

Deep Learning · Large Language Models

Daixuan Cheng, Shaohan Huang, Furu Wei

We explore how continued pre-training on domain-specific corpora influences large language models, revealing that training on the raw corpora endows the model with domain knowledge, but drastically hurts its prompting ability for question answering. Taken inspiration from human learning via reading comprehension--practice after reading improves the ability to answer questions based on the learned knowledge--we propose a simple method for transforming raw corpora into reading comprehension texts. Each raw text is enriched with a series of tasks related to its content. Our method, highly scalable and applicable to any pre-training corpora, consistently enhances performance across various tasks in three different domains: biomedicine, finance, and law. Notably, our 7B language model achieves competitive performance with domain-specific models of much larger scales, such as BloombergGPT-50B. Furthermore, we demonstrate that domain-specific reading comprehension texts can improve the model's performance even on general benchmarks, showing the potential to develop a general model across even more domains. Our model, code, and data are available at https://github.com/microsoft/LMOps.

Theory · Learning Theory

Licong Lin, Yu Bai, Song Mei

Large transformer models pretrained on offline reinforcement learning datasets have demonstrated remarkable in-context reinforcement learning (ICRL) capabilities, where they can make good decisions when prompted with interaction trajectories from unseen environments. However, when and how transformers can be trained to perform ICRL have not been theoretically well-understood. In particular, it is unclear which reinforcement-learning algorithms transformers can perform in context, and how distribution mismatch in offline training data affects the learned algorithms. This paper provides a theoretical framework that analyzes supervised pretraining for ICRL. This includes two recently proposed training methods --- algorithm distillation and decision-pretrained transformers. First, assuming model realizability, we prove the supervised-pretrained transformer will imitate the conditional expectation of the expert algorithm given the observed trajectory. The generalization error will scale with model capacity and a distribution divergence factor between the expert and offline algorithms. Second, we show transformers with ReLU attention can efficiently approximate near-optimal online reinforcement learning algorithms like LinUCB and Thompson sampling for stochastic linear bandits, and UCB-VI for tabular Markov decision processes. This provides the first quantitative analysis of the ICRL capabilities of transformers pretrained from offline trajectories.

Deep Learning · Sequential Models, Time series

Sophia Sun, Rose Yu

Accurate uncertainty measurement is a key step in building robust and reliable machine learning systems. Conformal prediction is a distribution-free uncertainty quantification framework popular for its ease of implementation, finite-sample coverage guarantees, and generality for underlying prediction algorithms. However, existing conformal prediction approaches for time series are limited to single-step prediction without considering the temporal dependency. In this paper, we propose the Copula Conformal Prediction algorithm for multivariate, multi-step Time Series forecasting, CopulaCPTS. We prove that CopulaCPTS has finite-sample validity guarantee. On four synthetic and real-world multivariate time series datasets, we show that CopulaCPTS produces more calibrated and efficient confidence intervals for multi-step prediction tasks than existing techniques. Our code is open-sourced at https://github.com/Rose-STL-Lab/CopulaCPTS.

Deep Learning · Generative Models and Autoencoders

Tserendorj Adiya, Jae Shin Yoon, Jung Eun Lee, Sanghun Kim, Hwasup Lim

We introduce a method to generate temporally coherent human animation from a single image, a video, or a random noise.This problem has been formulated as modeling of an auto-regressive generation, i.e., to regress past frames to decode future frames.However, such unidirectional generation is highly prone to motion drifting over time, generating unrealistic human animation with significant artifacts such as appearance distortion. We claim that bidirectional temporal modeling enforces temporal coherence on a generative network by largely suppressing the appearance ambiguity.To prove our claim, we design a novel human animation framework using a denoising diffusion model: a neural network learns to generate the image of a person by denoising temporal Gaussian noises whose intermediate results are cross-conditioned bidirectionally between consecutive frames. In the experiments, our method demonstrates strong performance compared to existing unidirectional approaches with realistic temporal coherence.

Reinforcement Learning

Wenhao Zhan, Masatoshi Uehara, Wen Sun, Jason Lee

Preference-based Reinforcement Learning (PbRL) is a paradigm in which an RL agent learns to optimize a task using pair-wise preference-based feedback over trajectories, rather than explicit reward signals. While PbRL has demonstrated practical success in fine-tuning language models, existing theoretical work focuses on regret minimization and fails to capture most of the practical frameworks. In this study, we fill in such a gap between theoretical PbRL and practical algorithms by proposing a theoretical reward-agnostic PbRL framework where exploratory trajectories that enable accurate learning of hidden reward functions are acquired before collecting any human feedback. Theoretical analysis demonstrates that our algorithm requires less human feedback for learning the optimal policy under preference-based models with linear parameterization and unknown transitions, compared to the existing theoretical literature. Specifically, our framework can incorporate linear and low-rank MDPs with efficient sample complexity. Additionally, we investigate reward-agnostic RL with action-based comparison feedback and introduce an efficient querying algorithm tailored to this scenario.

Applications · Computer Vision

Kim-Celine Kahl, Carsten Lüth, Maximilian Zenk, Klaus Maier-Hein, Paul F. Jaeger

Uncertainty estimation is an essential and heavily-studied component for the reliable application of semantic segmentation methods. While various studies exist claiming methodological advances on the one hand, and successful application on the other hand, the field is currently hampered by a gap between theory and practice leaving fundamental questions unanswered: Can data-related and model-related uncertainty really be separated in practice? Which components of an uncertainty method are essential for real-world performance? Which uncertainty method works well for which application? In this work, we link this research gap to a lack of systematic and comprehensive evaluation of uncertainty methods. Specifically, we identify three key pitfalls in current literature and present an evaluation framework that bridges the research gap by providing 1) a controlled environment for studying data ambiguities as well as distribution shifts, 2) systematic ablations of relevant method components, and 3) test-beds for the five predominant uncertainty applications: OoD-detection, active learning, failure detection, calibration, and ambiguity modeling. Empirical results on simulated as well as real-world data demonstrate how the proposed framework is able to answer the predominant questions in the field revealing for instance that 1) separation of uncertainty types works on simulated data but does not necessarily translate to real-world data, 2) aggregation of scores is a crucial but currently neglected component of uncertainty methods, 3) While ensembles are performing most robustly across the different downstream tasks and settings, test-time augmentation often constitutes a light-weight alternative. Code is at: https://github.com/IML-DKFZ/values

Deep Learning · Other Representation Learning

Linfeng Ye, Shayan Mohajer Hamidi, Renhao Tan, EN-HUI YANG

It is believed that in knowledge distillation (KD), the role of the teacher is to provide an estimate for the unknown Bayes conditional probability distribution (BCPD) to be used in the student training process. Conventionally, this estimate is obtained by training the teacher using maximum log-likelihood (MLL) method. To improve this estimate for KD, in this paper we introduce the concept of conditional mutual information (CMI) into the estimation of BCPD and propose a novel estimator called the maximum CMI (MCMI) method. Specifically, in MCMI estimation, both the log-likelihood and CMI of the teacher are simultaneously maximized when the teacher is trained. In fact, maximizing the teacher's CMI value ensures that the teacher can effectively capture the contextual information within the images, and for visualizing this information, we deploy Eigen-CAM. Via conducting a thorough set of experiments, we show that by employing a teacher trained via MCMI estimation rather than one trained via MLL estimation in various state-of-the-art KD frameworks, the student's classification accuracy consistently increases, with the gain of up to 3.32\%. This suggests that the teacher's BCPD estimate provided by MCMI method is more accurate than that provided by MLL method. In addition, we show that such improvements in the student's accuracy are more drastic in zero-shot and few-shot settings. Notably, the student's accuracy increases with the gain of up to 5.72\% when 5\% of the training samples are available to student (few-shot), and increases from 0\% to as high as 84\% for an omitted class (zero-shot).

Reinforcement Learning · Inverse

Jonathan Chang, Dhruv Sreenivas, Yingbing Huang, Kianté Brantley, Wen Sun

Adversarial imitation learning (AIL) has stood out as a dominant framework across various imitation learning (IL) applications, with Discriminator Actor Critic (DAC) demonstrating the effectiveness of off-policy learning algorithms in improving sample efficiency and scalability to higher-dimensional observations. Despite DAC’s empirical success, the original AIL objective is on-policy and DAC’s ad-hoc application of off-policy training does not guarantee successful imitation. Follow-up work such as ValueDICE tackles this issue by deriving a fully off-policy AIL objective. Instead in this work, we develop a novel and principled AIL algorithm via the framework of boosting. Like boosting, our new algorithm, AILBoost, maintains an ensemble of weighted weak learners (i.e., policies) and trains a discriminator that witnesses the maximum discrepancy between the distributions of the ensemble and the expert policy. We maintain a weighted replay buffer to represent the state-action distribution induced by the ensemble, allowing us to train discriminators using the entire data collected so far. Empirically, we evaluate our algorithm on both controller state-based and pixel-based environments from the DeepMind Control Suite. AILBoost outperforms DAC on both types of environments, demonstrating the benefit of properly weighting replay buffer data for off-policy training. On state-based environments, AILBoost outperforms ValueDICE and IQ-Learn, achieving state-of-the-art performance with as little as one expert trajectory.

Reinforcement Learning · Batch/Offline

Haruka Kiyohara, Ren Kishimoto, Kosuke Kawakami, Ken Kobayashi, Kazuhide Nakata, Yuta Saito

**Off-Policy Evaluation (OPE)** aims to assess the effectiveness of counterfactual policies using offline logged data and is frequently utilized to identify the top-$k$ promising policies for deployment in online A/B tests. Existing evaluation metrics for OPE estimators primarily focus on the "accuracy" of OPE or that of downstream policy selection, neglecting risk-return tradeoff and *efficiency* in subsequent online policy deployment. To address this issue, we draw inspiration from portfolio evaluation in finance and develop a new metric, called **SharpeRatio@k**, which measures the risk-return tradeoff and efficiency of policy portfolios formed by an OPE estimator under varying online evaluation budgets ($k$). We first demonstrate, in two example scenarios, that our proposed metric can clearly distinguish between conservative and high-stakes OPE estimators and reliably identify the most *efficient* estimator capable of forming superior portfolios of candidate policies that maximize return with minimal risk during online deployment, while existing evaluation metrics produce only degenerate results. To facilitate a quick, accurate, and consistent evaluation of OPE via SharpeRatio@k, we have also implemented the proposed metric in an open-source software. Using SharpeRatio@k and the software, we conduct a benchmark experiment of various OPE estimators regarding their risk-return tradeoff, presenting several future directions for OPE research.

Deep Learning · Generative Models and Autoencoders

Cheng Han, James Liang, Qifan Wang, MAJID RABBANI, Sohail Dianat, Raghuveer Rao, Yingnian Wu, Dongfang Liu

We introduce the novel Diffusion Visual Programmer (DVP), a neuro-symbolic image translation framework. Our proposed DVP seamlessly embeds a condition-flexible diffusion model within the GPT architecture, orchestrating a coherent sequence of visual programs ($i.e.$, computer vision models) for various pro-symbolic steps, which span RoI identification, style transfer, and position manipulation, facilitating transparent and controllable image translation processes. Extensive experiments demonstrate DVP’s remarkable performance, surpassing concurrent arts. This success can be attributed to several key features of DVP: First, DVP achieves condition-flexible translation via instance normalization, enabling the model to eliminate sensitivity caused by the manual guidance and optimally focus on textual descriptions for high-quality content generation. Second, the frame work enhances in-context reasoning by deciphering intricate high-dimensional concepts in feature spaces into more accessible low-dimensional symbols ($e.g.$, [Prompt], [RoI object]), allowing for localized, context-free editing while maintaining overall coherence. Last but not least, DVP improves systemic controllability and explainability by offering explicit symbolic representations at each programming stage, empowering users to intuitively interpret and modify results. Our research marks a substantial step towards harmonizing artificial image translation processes with cognitive intelligence, promising broader applications.

Miscellaneous Aspects of Machine Learning · Causality

Divyat Mahajan, Ioannis Mitliagkas, Brady Neal, Vasilis Syrgkanis

We study the problem of model selection in causal inference, specifically for conditional average treatment effect (CATE) estimation. Unlike machine learning, there is no perfect analogue of cross-validation for model selection as we do not observe the counterfactual potential outcomes. Towards this, a variety of surrogate metrics have been proposed for CATE model selection that use only observed data. However, we do not have a good understanding regarding their effectiveness due to limited comparisons in prior studies. We conduct an extensive empirical analysis to benchmark the surrogate model selection metrics introduced in the literature, as well as the novel ones introduced in this work. We ensure a fair comparison by tuning the hyperparameters associated with these metrics via AutoML, and provide more detailed trends by incorporating realistic datasets via generative modeling. Our analysis suggests novel model selection strategies based on careful hyperparameter selection of CATE estimators and causal ensembling.

Deep Learning · Large Language Models

Adrian Bazaga, Pietro Lio, Gos Micklem

Fact verification aims to verify a claim using evidence from a trustworthy knowledge base. To address this challenge, algorithms must produce features for every claim that are both semantically meaningful, and compact enough to find a semantic alignment with the source information. In contrast to previous work, which tackled the alignment problem by learning over annotated corpora of claims and their corresponding labels, we propose SFAVEL ($\underline{S}$elf-supervised $\underline{Fa}$ct $\underline{Ve}$rification via $\underline{L}$anguage Model Distillation), a novel unsupervised pretraining framework that leverages pre-trained language models to distil self-supervised features into high-quality claim-fact alignments without the need for annotations. This is enabled by a novel contrastive loss function that encourages features to attain high-quality claim and evidence alignments whilst preserving the semantic relationships across the corpora. Notably, we present results that achieve a new state-of-the-art on FB15k-237 (+5.3\% Hits@1) and FEVER (+8\% accuracy) with linear evaluation.

Social Aspects · Fairness, Equity, Justice and Safety

Shenyu Lu, Yipei Wang, Xiaoqian Wang

Although transformers demonstrate impressive capabilities in a variety of tasks, the fairness issue remains a significant concern when deploying these models. Existing works to address fairness issues in transformers require sensitive labels (such as age, gender, etc.), which can raise privacy concerns or violate legal regulations. An alternative way is through fairness without demographics. However, existing works that improve Rawlsian Max-Min fairness may impose overly restrictive constraints. Other methods that use auxiliary networks could be parameter inefficient. In this paper, we present a new approach to debiasing transformers by leveraging their inherent structure. By reconsidering the roles of important components (queries, keys, and values) in the attention mechanism, we introduce a simple yet effective debiasing strategy from two perspectives: 1) Grounded in theoretical analysis, we normalize and apply absolute value operations to queries and keys to minimize the bias in attention weight allocation; 2) We reduce the bias within values through local alignment via contrastive learning. Throughout the entire process, our approach does not require any sensitive labels. Furthermore, to enhance memory efficiency in the training phase, we propose a strategy that debias only the last encoder to improve fairness in pre-trained models. We conduct experiments in computer vision and natural language processing tasks and show that our method is comparable and even outperforms the state-of-the-art method with substantially lower energy consumption.

Deep Learning · Self-Supervised Learning

Maryam Haghighat, Peyman Moghadam, Shaheer Mohamed, Piotr Koniusz

Masked Image Modeling (MIM) is a powerful self-supervised strategy for visual pre-training without the use of labels. MIM applies random crops to input images, processes them with an encoder, and then recovers the masked inputs with a decoder, which encourages the network to capture and learn structural information about objects and scenes. The intermediate feature representations obtained from MIM are suitable for fine-tuning on downstream tasks. In this paper, we propose an Image Modeling framework based on random orthogonal projection instead of binary masking as in MIM. Our proposed Random Orthogonal Projection Image Modeling (ROPIM) reduces spatially-wise token information under guaranteed bound on the noise variance and can be considered as masking entire spatial image area under locally varying masking degrees. Since ROPIM uses a random subspace for the projection that realizes the masking step, the readily available complement of the subspace can be used during unmasking to promote recovery of removed information. In this paper, we show that using random orthogonal projection leads to superior performance compared to crop-based masking. We demonstrate state-of-the-art results on several popular benchmarks.

Deep Learning · Other Representation Learning

Wu Ran, Peirong Ma, Zhiquan He, Hao Ren, Hong Lu

Recent advances in image deraining have focused on training powerful models on mixed multiple datasets comprising diverse rain types and backgrounds. However, this approach tends to overlook the inherent differences among rainy images, leading to suboptimal results. To overcome this limitation, we focus on addressing various rainy images by delving into meaningful representations that encapsulate both the rain and background components. Leveraging these representations as instructive guidance, we put forth a Context-based Instance-level Modulation (CoI-M) mechanism adept at efficiently modulating CNN- or Transformer-based models. Furthermore, we devise a rain-/detail-aware contrastive learning strategy to help extract joint rain-/detail-aware representations. By integrating CoI-M with the rain-/detail-aware Contrastive learning, we develop [CoIC](https://github.com/Schizophreni/CoIC), an innovative and potent algorithm tailored for training models on mixed datasets. Moreover, CoIC offers insight into modeling relationships of datasets, quantitatively assessing the impact of rain and details on restoration, and unveiling distinct behaviors of models given diverse inputs. Extensive experiments validate the efficacy of CoIC in boosting the deraining ability of CNN and Transformer models. CoIC also enhances the deraining prowess remarkably when real-world dataset is included.

Deep Learning · Large Language Models

Keming Lu, Hongyi Yuan, Zheng Yuan, Runji Lin, Junyang Lin, Chuanqi Tan, Chang Zhou, Jingren Zhou

Pre-trained large language models (LLMs) can understand and align with human instructions by supervised fine-tuning (SFT).It is commonly believed that diverse and complex SFT data are of the essence to enable good instruction-following abilities.However, such diversity and complexity are obscure and lack quantitative analyses.In this work, we propose InsTag, an open-set instruction tagging method, to identify semantics and intentions of human instructions by tags that provide access to definitions and quantified analyses of instruction diversity and complexity.We obtain 6.6K fine-grained tags to describe instructions from popular open-sourced SFT datasets comprehensively.We find that the abilities of aligned LLMs benefit from more diverse and complex instructions in SFT data.Based on this observation, we propose a data sampling procedure based on InsTag, and select 6K diverse and complex samples from open-source datasets for SFT.The resulting models, TagLM, outperform open-source models based on considerably larger SFT data evaluated by MT-Bench, echoing the importance of instruction diversity and complexity and the effectiveness of InsTag.InsTag has robust potential to be extended to more applications beyond the data selection as it provides an effective way to analyze the distribution of instructions.

Applications · Language, Speech and Dialog

Kang Liu

Taking inspiration from Set Theory, we introduce SetCSE, an innovative information retrieval framework. SetCSE employs sets to represent complex semantics and incorporates well-defined operations for structured information querying under the provided context. Within this framework, we introduce an inter-set contrastive learning objective to enhance comprehension of sentence embedding models concerning the given semantics. Furthermore, we present a suite of operations, including SetCSE intersection, difference, and operation series, that leverage sentence embeddings of the enhanced model for complex sentence retrieval tasks. Throughout this paper, we demonstrate that SetCSE adheres to the conventions of human language expressions regarding compounded semantics, provides a significant enhancement in the discriminatory capability of underlying sentence embedding models, and enables numerous information retrieval tasks involving convoluted and intricate prompts which cannot be achieved using existing querying methods.

Reinforcement Learning · Multi-agent

Simin Li, Jun Guo, Jingqiao Xiu, Ruixiao Xu, Xin Yu, Jiakai Wang, Aishan Liu, Yaodong Yang, Xianglong Liu

In this study, we explore the robustness of cooperative multi-agent reinforcement learning (c-MARL) against Byzantine failures, where any agent can enact arbitrary, worst-case actions due to malfunction or adversarial attack. To address the uncertainty that any agent can be adversarial, we propose a Bayesian Adversarial Robust Dec-POMDP (BARDec-POMDP) framework, which views Byzantine adversaries as nature-dictated types, represented by a separate transition. This allows agents to learn policies grounded on their posterior beliefs about the type of other agents, fostering collaboration with identified allies and minimizing vulnerability to adversarial manipulation. We define the optimal solution to the BARDec-POMDP as an ex interim robust Markov perfect Bayesian equilibrium, which we proof to exist and the corresponding policy weakly dominates previous approaches as time goes to infinity. To realize this equilibrium, we put forward a two-timescale actor-critic algorithm with almost sure convergence under specific conditions. Experiments on matrix game, Level-based Foraging and StarCraft II indicate that, our method successfully acquires intricate micromanagement skills and adaptively aligns with allies under worst-case perturbations, showing resilience against non-oblivious adversaries, random allies, observation-based attacks, and transfer-based attacks.

Tianjian Li, Haoran Xu, Philipp Koehn, Daniel Khashabi, Kenton Murray

Text generation models are notoriously vulnerable to errors in the training data. With the wide-spread availability of massive amounts of web-crawled data becoming more commonplace, how can we enhance the robustness of models trained on a massive amount of noisy web-crawled text? In our work, we propose Error Norm Truncation (ENT), a robust enhancement method to the standard training objective that truncates noisy data. Compared to methods that only uses the negative log-likelihood loss to estimate data quality, our method provides a more accurate estimation by considering the distribution of non-target tokens, which is often overlooked by previous work. Through comprehensive experiments across language modeling, machine translation, and text summarization, we show that equipping text generation models with ENT improves generation quality over standard training and previous soft and hard truncation methods. Furthermore, we show that our method improves the robustness of models against two of the most detrimental types of noise in machine translation, resulting in an increase of more than 2 BLEU points over the MLE baseline when up to 50\% of noise is added to the data.