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Yiming Yang 0002

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32 papers
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32

ICLR Conference 2025 Conference Paper

Inference Scaling Laws: An Empirical Analysis of Compute-Optimal Inference for LLM Problem-Solving

  • Yangzhen Wu
  • Zhiqing Sun
  • Shanda Li
  • Sean Welleck
  • Yiming Yang 0002

While the scaling laws of large language models (LLMs) training have been extensively studied, optimal inference configurations of LLMs remain underexplored. We study inference scaling laws (aka test-time scaling laws) and compute-optimal inference, focusing on the trade-offs between model sizes and generating additional tokens with different inference strategies. As a first step towards understanding and designing compute-optimal inference methods, we studied cost-performance trade-offs for inference strategies such as greedy search, majority voting, best-of-$n$, weighted voting, and two different tree search algorithms, using different model sizes and compute budgets. Our findings suggest that scaling inference compute with inference strategies can be more computationally efficient than scaling model parameters. Additionally, smaller models combined with advanced inference algorithms offer Pareto-optimal trade-offs in cost and performance. For example, the Llemma-7B model, when paired with our novel tree search algorithm, consistently outperforms the Llemma-34B model across all tested inference strategies on the MATH benchmark. We hope these insights contribute to a deeper understanding of inference scaling laws (test-time scaling laws) for LLMs.

ICLR Conference 2025 Conference Paper

Lean-STaR: Learning to Interleave Thinking and Proving

  • Haohan Lin
  • Zhiqing Sun
  • Sean Welleck
  • Yiming Yang 0002

Traditional language model-based theorem proving assumes that by training on a sufficient amount of formal proof data, a model will learn to prove theorems. Our key observation is that a wealth of informal information that is not present in formal proofs can be useful for learning to prove theorems. For instance, humans think through steps of a proof, but this thought process is not visible in the resulting code. We present Lean-STaR, a framework for training language models to produce informal thoughts prior to each step of a proof, thereby boosting the model's theorem-proving capabilities. Lean-STaR uses retrospective ground-truth tactics to generate synthetic thoughts for training the language model. At inference time, the trained model directly generates the thoughts prior to the prediction of the tactics in each proof step. Building on the self-taught reasoner framework, we then apply expert iteration to further fine-tune the model on the correct proofs it samples and verifies using the Lean solver. Lean-STaR significantly outperform base models (43.4% → 46.3%, Pass@64). We also analyze the impact of the augmented thoughts on various aspects of the theorem proving process, providing insights into their effectiveness.

ICML Conference 2025 Conference Paper

Maximal Update Parametrization and Zero-Shot Hyperparameter Transfer for Fourier Neural Operators

  • Shanda Li
  • Shinjae Yoo
  • Yiming Yang 0002

Fourier Neural Operators (FNOs) offer a principled approach for solving complex partial differential equations (PDEs). However, scaling them to handle more complex PDEs requires increasing the number of Fourier modes, which significantly expands the number of model parameters and makes hyperparameter tuning computationally impractical. To address this, we introduce $\mu$ Transfer-FNO, a zero-shot hyperparameter transfer technique that enables optimal configurations, tuned on smaller FNOs, to be directly applied to billion-parameter FNOs without additional tuning. Building on the Maximal Update Parametrization ($\mu$P) framework, we mathematically derive a parametrization scheme that facilitates the transfer of optimal hyperparameters across models with different numbers of Fourier modes in FNOs, which is validated through extensive experiments on various PDEs. Our empirical study shows that $\mu$Transfer-FNO reduces computational cost for tuning hyperparameters on large FNOs while maintaining or improving accuracy.

ICML Conference 2025 Conference Paper

Optimizing Temperature for Language Models with Multi-Sample Inference

  • Weihua Du
  • Yiming Yang 0002
  • Sean Welleck

Multi-sample aggregation strategies, such as majority voting and best-of-N sampling, are widely used in contemporary large language models (LLMs) to enhance predictive accuracy across various tasks. A key challenge in this process is temperature selection, which significantly impacts model performance. Existing approaches either rely on a fixed default temperature or require labeled validation data for tuning, which are often scarce and difficult to obtain. This paper addresses the challenge of automatically identifying the (near)-optimal temperature for different LLMs using multi-sample aggregation strategies, without relying on task-specific validation data. We provide a comprehensive analysis of temperature’s role in performance optimization, considering variations in model architectures, datasets, task types, model sizes, and predictive accuracy. Furthermore, we propose a novel entropy-based metric for automated temperature optimization, which consistently outperforms fixed-temperature baselines. Additionally, we incorporate a stochastic process model to enhance interpretability, offering deeper insights into the relationship between temperature and model performance.

ICML Conference 2025 Conference Paper

Regularized Langevin Dynamics for Combinatorial Optimization

  • Shengyu Feng
  • Yiming Yang 0002

This work proposes a simple yet effective sampling framework for combinatorial optimization (CO). Our method builds on discrete Langevin dynamics (LD), an efficient gradient-guided generative paradigm. However, we observe that directly applying LD often leads to limited exploration. To overcome this limitation, we propose the Regularized Langevin Dynamics (RLD), which enforces an expected distance between the sampled and current solutions, effectively avoiding local minima. We develop two CO solvers on top of RLD, one based on simulated annealing (SA), and the other one based on neural network (NN). Empirical results on three classic CO problems demonstrate that both of our methods can achieve comparable or better performance against the previous state-of-the-art (SOTA) SA- and NN-based solvers. In particular, our SA algorithm reduces the runtime of the previous SOTA SA method by up to 80%, while achieving equal or superior performance. In summary, RLD offers a promising framework for enhancing both traditional heuristics and NN models to solve CO problems. Our code is available at https: //github. com/Shengyu-Feng/RLD4CO.

ICLR Conference 2025 Conference Paper

Self-Play Preference Optimization for Language Model Alignment

  • Yue Wu
  • Zhiqing Sun
  • Huizhuo Yuan
  • Kaixuan Ji
  • Yiming Yang 0002
  • Quanquan Gu

Standard reinforcement learning from human feedback (RLHF) approaches relying on parametric models like the Bradley-Terry model fall short in capturing the intransitivity and irrationality in human preferences. Recent advancements suggest that directly working with preference probabilities can yield a more accurate reflection of human preferences, enabling more flexible and accurate language model alignment. In this paper, we propose a self-play-based method for language model alignment, which treats the problem as a constant-sum two-player game aimed at identifying the Nash equilibrium policy. Our approach, dubbed *Self-Play Preference Optimization* (SPPO), utilizes iterative policy updates to provably approximate the Nash equilibrium. Additionally, we propose a new SPPO objective which is both strongly motivated by theory and is simple and effective in practice. In our experiments, using only 60k prompts (without responses) from the UltraFeedback dataset and without any prompt augmentation, by leveraging a pre-trained preference model PairRM with only 0.4B parameters, SPPO can obtain a model from fine-tuning Mistral-7B-Instruct-v0.2 that achieves the state-of-the-art length-controlled win-rate of 28.53\% against GPT-4-Turbo on AlpacaEval 2.0. It also outperforms the (iterative) DPO and IPO on MT-Bench, Arena-Hard, and the Open LLM Leaderboard. Starting from a stronger base model Llama-3-8B-Instruct, we are able to achieve a length-controlled win rate of 38.77\%. Notably, the strong performance of SPPO is achieved without additional external supervision (e.g., responses, preferences, etc.) from GPT-4 or other stronger language models.

ICLR Conference 2025 Conference Paper

Step-by-Step Reasoning for Math Problems via Twisted Sequential Monte Carlo

  • Shengyu Feng
  • Xiang Kong
  • Shuang Ma
  • Aonan Zhang
  • Dong Yin
  • Chong Wang
  • Ruoming Pang
  • Yiming Yang 0002

Augmenting the multi-step reasoning abilities of Large Language Models (LLMs) has been a persistent challenge. Recently, verification has shown promise in improving solution consistency by evaluating generated outputs. However, current verification approaches suffer from sampling inefficiencies, requiring a large number of samples to achieve satisfactory performance. Additionally, training an effective verifier often depends on extensive process supervision, which is costly to acquire. In this paper, we address these limitations by introducing a novel verification method based on Twisted Sequential Monte Carlo (TSMC). TSMC sequentially refines its sampling effort to focus exploration on promising candidates, resulting in more efficient generation of high-quality solutions. We apply TSMC to LLMs by estimating the expected future rewards at partial solutions. This approach results in a more straightforward training target that eliminates the need for step-wise human annotations. We empirically demonstrate the advantages of our method across multiple math benchmarks, and also validate our theoretical analysis of both our approach and existing verification methods.

ICLR Conference 2024 Conference Paper

Functional Interpolation for Relative Positions improves Long Context Transformers

  • Shanda Li
  • Chong You
  • Guru Guruganesh
  • Joshua Ainslie
  • Santiago Ontañón
  • Manzil Zaheer
  • Sumit Sanghai
  • Yiming Yang 0002

Preventing the performance decay of Transformers on inputs longer than those used for training has been an important challenge in extending the context length of these models. Though the Transformer architecture has fundamentally no limits on the input sequence lengths it can process, the choice of position encoding used during training can limit the performance of these models on longer inputs. We propose a novel functional relative position encoding with progressive interpolation, FIRE, to improve Transformer generalization to longer contexts. We theoretically prove that this can represent some of the popular relative position encodings, such as T5's RPE, Alibi, and Kerple. We next empirically show that FIRE models have better generalization to longer contexts on both zero-shot language modeling and long text benchmarks.

ICML Conference 2024 Conference Paper

In-Context Principle Learning from Mistakes

  • Tianjun Zhang
  • Aman Madaan
  • Luyu Gao
  • Steven Zheng
  • Swaroop Mishra
  • Yiming Yang 0002
  • Niket Tandon
  • Uri Alon 0002

In-context learning (ICL, also known as few-shot prompting) has been the standard method of adapting LLMs to downstream tasks, by learning from a few input-output examples. Nonetheless, all ICL-based approaches only learn from correct input-output pairs. In this paper, we revisit this paradigm, by learning more from the few given input-output examples. We introduce Learning Principles (LEAP): First, we intentionally induce the model to make mistakes on these few examples; then we reflect on these mistakes, and learn explicit task-specific “principles” from them, which help solve similar problems and avoid common mistakes; finally, we prompt the model to answer unseen test questions using the original few-shot examples and these learned general principles. We evaluate LEAP on a wide range of benchmarks, including multi-hop question answering (Hotpot QA), textual QA (DROP), Big-Bench Hard reasoning, and math problems (GSM8K and MATH); in all these benchmarks, LEAP improves the strongest available LLMs such as GPT-3. 5-turbo, GPT-4, GPT-4-turbo and Claude-2. 1. For example, LEAP improves over the standard few-shot prompting using GPT-4 by 7. 5% in DROP, and by 3. 3% in HotpotQA. Importantly, LEAP does not require any more input or examples than the standard few-shot prompting settings.

ICLR Conference 2024 Conference Paper

Learning Performance-Improving Code Edits

  • Alexander Shypula
  • Aman Madaan
  • Yimeng Zeng
  • Uri Alon 0002
  • Jacob R. Gardner
  • Yiming Yang 0002
  • Milad Hashemi
  • Graham Neubig

With the decline of Moore's law, optimizing program performance has become a major focus of software research. However, high-level optimizations such as API and algorithm changes remain elusive due to the difficulty of understanding the semantics of code. Simultaneously, pretrained large language models (LLMs) have demonstrated strong capabilities at solving a wide range of programming tasks. To that end, we introduce a framework for adapting LLMs to high-level program optimization. First, we curate a dataset of performance-improving edits made by human programmers of over 77,000 competitive C++ programming submission pairs, accompanied by extensive unit tests. A major challenge is the significant variability of measuring performance on commodity hardware, which can lead to spurious "improvements." To isolate and reliably evaluate the impact of program optimizations, we design an environment based on the gem5 full system simulator, the de facto simulator used in academia and industry. Next, we propose a broad range of adaptation strategies for code optimization; for prompting, these include retrieval-based few-shot prompting and chain-of-thought, and for finetuning, these include performance-conditioned generation and synthetic data augmentation based on self-play. A combination of these techniques achieves a mean speedup of 6.86$\times$ with eight generations, higher than average optimizations from individual programmers (3.66$\times$). Using our model's fastest generations, we set a new upper limit on the fastest speedup possible for our dataset at 9.64$\times$ compared to using the fastest human submissions available (9.56$\times$).

ICLR Conference 2024 Conference Paper

SALMON: Self-Alignment with Instructable Reward Models

  • Zhiqing Sun
  • Yikang Shen
  • Hongxin Zhang
  • Qinhong Zhou
  • Zhenfang Chen
  • David D. Cox
  • Yiming Yang 0002
  • Chuang Gan 0001

Supervised Fine-Tuning (SFT) on response demonstrations combined with Reinforcement Learning from Human Feedback (RLHF) constitutes a powerful paradigm for aligning LLM-based AI agents. However, a significant limitation of such an approach is its dependency on high-quality human annotations, making its application to intricate tasks challenging due to difficulties in obtaining consistent response demonstrations and in-distribution response preferences. This paper presents a novel approach, namely SALMON, to align base language models with minimal human supervision, using only a small set of human-defined principles, yet achieving superior performance. Central to our approach is an instructable reward model. Trained on synthetic preference data, this model can generate reward scores based on arbitrary human-defined principles. By merely adjusting these principles during the RL training phase, we gain full control over the preferences with the instructable reward model, subsequently influencing the behavior of the RL-trained policy models, and reducing the reliance on the collection of online human preferences. Applying our method to the LLaMA-2-70b base language model, we developed an AI assistant named Dromedary-2. With only 6 exemplars for in-context learning and 31 human-defined principles, Dromedary-2 significantly surpasses the performance of several state-of-the-art AI systems, including LLaMA-2-Chat-70b, on various benchmark datasets. We have open-sourced the code and model weights to encourage further research into aligning LLM-based AI agents with enhanced supervision efficiency, improved controllability, and scalable oversight.

ICML Conference 2023 Conference Paper

A Neural PDE Solver with Temporal Stencil Modeling

  • Zhiqing Sun
  • Yiming Yang 0002
  • Shinjae Yoo

Numerical simulation of non-linear partial differential equations plays a crucial role in modeling physical science and engineering phenomena, such as weather, climate, and aerodynamics. Recent Machine Learning (ML) models trained on low-resolution spatio-temporal signals have shown new promises in capturing important dynamics in high-resolution signals, under the condition that the models can effectively recover the missing details. However, this study shows that significant information is often lost in the low-resolution down-sampled features. To address such issues, we propose a new approach, namely Temporal Stencil Modeling (TSM), which combines the strengths of advanced time-series sequence modeling (with the HiPPO features) and state-of-the-art neural PDE solvers (with learnable stencil modeling). TSM aims to recover the lost information from the PDE trajectories and can be regarded as a temporal generalization of classic finite volume methods such as WENO. Our experimental results show that TSM achieves the new state-of-the-art simulation accuracy for 2-D incompressible Navier-Stokes turbulent flows: it significantly outperforms the previously reported best results by 19. 9% in terms of the highly-correlated duration time, and reduces the inference latency into 80%. We also show a strong generalization ability of the proposed method to various out-of-distribution turbulent flow settings, as well as lower resolution or 1-D / 3-D settings. Our code is available at https: //github. com/Edward-Sun/TSM-PDE.

ICML Conference 2023 Conference Paper

PAL: Program-aided Language Models

  • Luyu Gao
  • Aman Madaan
  • Shuyan Zhou
  • Uri Alon 0002
  • Pengfei Liu 0003
  • Yiming Yang 0002
  • Jamie Callan
  • Graham Neubig

Large language models (LLMs) have demonstrated an impressive ability to perform arithmetic and symbolic reasoning tasks, when provided with a few examples at test time ("few-shot prompting"). Much of this success can be attributed to prompting methods such as "chain-of-thought", which employ LLMs for both understanding the problem description by decomposing it into steps, as well as solving each step of the problem. While LLMs seem to be adept at this sort of step-by-step decomposition, LLMs often make logical and arithmetic mistakes in the solution part, even when the problem is decomposed correctly. In this paper, we present Program-Aided Language models (PAL): a novel approach that uses the LLM to read natural language problems and generate programs as the intermediate reasoning steps, but offloads the solution step to a runtime such as a Python interpreter. With PAL, decomposing the natural language problem into runnable steps remains the only learning task for the LLM, while solving is delegated to the interpreter. We demonstrate this synergy between a neural LLM and a symbolic interpreter across 13 mathematical, symbolic, and algorithmic reasoning tasks from BIG-Bench Hard and others. In all these natural language reasoning tasks, generating code using an LLM and reasoning using a Python interpreter leads to more accurate results than much larger models. For example, PAL using Codex achieves state-of-the-art few-shot accuracy on GSM8K, surpassing PaLM which uses chain-of-thought by absolute 15% top-1.

ICLR Conference 2023 Conference Paper

Recitation-Augmented Language Models

  • Zhiqing Sun
  • Xuezhi Wang 0002
  • Yi Tay
  • Yiming Yang 0002
  • Denny Zhou

We propose a new paradigm to help Large Language Models (LLMs) generate more accurate factual knowledge without retrieving from an external corpus, called RECITation-augmented gEneration (RECITE). Different from retrieval-augmented language models that retrieve relevant documents before generating the outputs, given an input, RECITE first recites one or several relevant passages from LLMs’ own memory via sampling, and then produces the final answers. We show that RECITE is a powerful paradigm for knowledge-intensive NLP tasks. Specifically, we show that by utilizing recitation as the intermediate step, a recite-and-answer scheme can achieve new state-of-the-art performance in various closed-book question answering (CBQA) tasks. In experiments, we verify the effectiveness of RECITE on three pre-trained models (In-house LM, UL2, and OPT) and three CBQA tasks (Natural Questions, TriviaQA, and HotpotQA). Our code is available at "https://github.com/Edward-Sun/RECITE".

ICLR Conference 2022 Conference Paper

Sparse Attention with Learning to Hash

  • Zhiqing Sun
  • Yiming Yang 0002
  • Shinjae Yoo

Transformer has become ubiquitous in sequence modeling tasks. As a key component of Transformer, self-attention does not scale to long sequences due to its quadratic time and space complexity with respect to the sequence length. To tackle this problem, recent work developed dynamic attention sparsification techniques based on Approximate Nearest Neighbor (ANN) methods, where similar queries and keys are allocated to the same hash bucket with high probability. However, the effectiveness of those ANN methods relies on the assumption that queries and keys should lie in the same space, which is not well justified. Besides, some of the ANN methods such as Locality-Sensitive Hashing (LSH) are randomized and cannot fully utilize the available real data distributions. To overcome these issues, this paper proposes a new strategy for sparse attention, namely LHA (Learning-to-Hash Attention), which directly learns separate parameterized hash functions for queries and keys, respectively. Another advantage of LHA is that it does not impose extra constraints for queries and keys, which makes it applicable to the wide range of pre-trained Transformer models. Our experiments on evaluation of the WikiText-103 dataset for language modeling, the GLUE benchmark for natural language understanding, and the Lang-Range-Arena benchmark for multiple tasks (text/image classification, retrieval, etc.) show the superior performance of LHA over other strong Transformer variants.

ICLR Conference 2021 Conference Paper

Meta Back-Translation

  • Hieu Pham
  • Xinyi Wang 0001
  • Yiming Yang 0002
  • Graham Neubig

Back-translation is an effective strategy to improve the performance of Neural Machine Translation~(NMT) by generating pseudo-parallel data. However, several recent works have found that better translation quality in the pseudo-parallel data does not necessarily lead to a better final translation model, while lower-quality but diverse data often yields stronger results instead. In this paper we propose a new way to generate pseudo-parallel data for back-translation that directly optimizes the final model performance. Specifically, we propose a meta-learning framework where the back-translation model learns to match the forward-translation model's gradients on the development data with those on the pseudo-parallel data. In our evaluations in both the standard datasets WMT En-De'14 and WMT En-Fr'14, as well as a multilingual translation setting, our method leads to significant improvements over strong baselines.

ICML Conference 2020 Conference Paper

An EM Approach to Non-autoregressive Conditional Sequence Generation

  • Zhiqing Sun
  • Yiming Yang 0002

Autoregressive (AR) models have been the dominating approach to conditional sequence generation, but are suffering from the issue of high inference latency. Non-autoregressive (NAR) models have been recently proposed to reduce the latency by generating all output tokens in parallel but could only achieve inferior accuracy compared to their autoregressive counterparts, primarily due to a difficulty in dealing with the multi-modality in sequence generation. This paper proposes a new approach that jointly optimizes both AR and NAR models in a unified Expectation-Maximization (EM) framework. In the E-step, an AR model learns to approximate the regularized posterior of the NAR model. In the M-step, the NAR model is updated on the new posterior and selects the training examples for the next AR model. This iterative process can effectively guide the system to remove the multi-modality in the output sequences. To our knowledge, this is the first EM approach to NAR sequence generation. We evaluate our method on the task of machine translation. Experimental results on benchmark data sets show that the proposed approach achieves competitive, if not better, performance with existing NAR models and significantly reduces the inference latency.

ICLR Conference 2020 Conference Paper

Cross-lingual Alignment vs Joint Training: A Comparative Study and A Simple Unified Framework

  • Zirui Wang
  • Jiateng Xie
  • Ruochen Xu
  • Yiming Yang 0002
  • Graham Neubig
  • Jaime G. Carbonell

Learning multilingual representations of text has proven a successful method for many cross-lingual transfer learning tasks. There are two main paradigms for learning such representations: (1) alignment, which maps different independently trained monolingual representations into a shared space, and (2) joint training, which directly learns unified multilingual representations using monolingual and cross-lingual objectives jointly. In this paper, we first conduct direct comparisons of representations learned using both of these methods across diverse cross-lingual tasks. Our empirical results reveal a set of pros and cons for both methods, and show that the relative performance of alignment versus joint training is task-dependent. Stemming from this analysis, we propose a simple and novel framework that combines these two previously mutually-exclusive approaches. Extensive experiments demonstrate that our proposed framework alleviates limitations of both approaches, and outperforms existing methods on the MUSE bilingual lexicon induction (BLI) benchmark. We further show that this framework can generalize to contextualized representations such as Multilingual BERT, and produces state-of-the-art results on the CoNLL cross-lingual NER benchmark.

ICLR Conference 2020 Conference Paper

Pre-training Tasks for Embedding-based Large-scale Retrieval

  • Wei-Cheng Chang
  • Felix X. Yu
  • Yin-Wen Chang
  • Yiming Yang 0002
  • Sanjiv Kumar

We consider the large-scale query-document retrieval problem: given a query (e.g., a question), return the set of relevant documents (e.g., paragraphs containing the answer) from a large document corpus. This problem is often solved in two steps. The retrieval phase first reduces the solution space, returning a subset of candidate documents. The scoring phase then re-ranks the documents. Critically, the retrieval algorithm not only desires high recall but also requires to be highly efficient, returning candidates in time sublinear to the number of documents. Unlike the scoring phase witnessing significant advances recently due to the BERT-style pre-training tasks on cross-attention models, the retrieval phase remains less well studied. Most previous works rely on classic Information Retrieval (IR) methods such as BM-25 (token matching + TF-IDF weights). These models only accept sparse handcrafted features and can not be optimized for different downstream tasks of interest. In this paper, we conduct a comprehensive study on the embedding-based retrieval models. We show that the key ingredient of learning a strong embedding-based Transformer model is the set of pre-training tasks. With adequately designed paragraph-level pre-training tasks, the Transformer models can remarkably improve over the widely-used BM-25 as well as embedding models without Transformers. The paragraph-level pre-training tasks we studied are Inverse Cloze Task (ICT), Body First Selection (BFS), Wiki Link Prediction (WLP), and the combination of all three.

ICML Conference 2017 Conference Paper

Analogical Inference for Multi-relational Embeddings

  • Hanxiao Liu
  • Yuexin Wu
  • Yiming Yang 0002

Large-scale multi-relational embedding refers to the task of learning the latent representations for entities and relations in large knowledge graphs. An effective and scalable solution for this problem is crucial for the true success of knowledge-based inference in a broad range of applications. This paper proposes a novel framework for optimizing the latent representations with respect to the analogical properties of the embedded entities and relations. By formulating the objective function in a differentiable fashion, our model enjoys both its theoretical power and computational scalability, and significantly outperformed a large number of representative baseline methods on benchmark datasets. Furthermore, the model offers an elegant unification of several well-known methods in multi-relational embedding, which can be proven to be special instantiations of our framework.

ICML Conference 2016 Conference Paper

Cross-Graph Learning of Multi-Relational Associations

  • Hanxiao Liu
  • Yiming Yang 0002

Cross-graph Relational Learning (CGRL) refers to the problem of predicting the strengths or labels of multi-relational tuples of heterogeneous object types, through the joint inference over multiple graphs which specify the internal connections among each type of objects. CGRL is an open challenge in machine learning due to the daunting number of all possible tuples to deal with when the numbers of nodes in multiple graphs are large, and because the labeled training instances are extremely sparse as typical. Existing methods such as tensor factorization or tensor-kernel machines do not work well because of the lack of convex formulation for the optimization of CGRL models, the poor scalability of the algorithms in handling combinatorial numbers of tuples, and/or the non-transductive nature of the learning methods which limits their ability to leverage unlabeled data in training. This paper proposes a novel framework which formulates CGRL as a convex optimization problem, enables transductive learning using both labeled and unlabeled tuples, and offers a scalable algorithm that guarantees the optimal solution and enjoys a constant time complexity with respect to the sizes of input graphs. In our experiments with a subset of DBLP publication records and an Enzyme multi-source dataset, the proposed method successfully scaled to the large cross-graph inference problem, and outperformed other representative approaches significantly.

ICML Conference 2015 Conference Paper

Bipartite Edge Prediction via Transductive Learning over Product Graphs

  • Hanxiao Liu
  • Yiming Yang 0002

This paper addresses the problem of predicting the missing edges of a bipartite graph where each side of the vertices has its own intrinsic structure. We propose a new optimization framework to map the two sides of the intrinsic structures onto the manifold structure of the edges via a graph product, and to reduce the original problem to vertex label propagation over the product graph. This framework enjoys flexible choices in the formulation of graph products, and supports a rich family of graph transduction schemes with scalable inference. Experiments on benchmark datasets for collaborative filtering, citation network analysis and prerequisite prediction of online courses show advantageous performance of the proposed approach over other state-of-the-art methods.

UAI Conference 2014 Conference Paper

Transformation-based Probabilistic Clustering with Supervision

  • Siddharth Gopal
  • Yiming Yang 0002

One of the common problems with clustering is that the generated clusters often do not match user expectations. This paper proposes a novel probabilistic framework that exploits supervised information in a discriminative and transferable manner to generate better clustering of unlabeled data. The supervision is provided by revealing the cluster assignments for some subset of the ground truth clusters and is used to learn a transformation of the data such that labeled instances form well-separated clusters with respect to the given clustering objective. This estimated transformation function enables us to fold the remaining unlabeled data into a space where new clusters hopefully match user expectations. While our framework is general, in this paper, we focus on its application to Gaussian and von Mises- Fisher mixture models. Extensive testing on 23 data sets across several application domains revealed substantial improvement in performance over competing methods.

ICML Conference 2014 Conference Paper

Von Mises-Fisher Clustering Models

  • Siddharth Gopal
  • Yiming Yang 0002

This paper proposes a suite of models for clustering high-dimensional data on a unit sphere based on Von Mises-Fisher (vMF) distribution and for discovering more intuitive clusters than existing approaches. The proposed models include a) A Bayesian formulation of vMF mixture that enables information sharing among clusters, b) a Hierarchical vMF mixture that provides multi-scale shrinkage and tree structured view of the data and c) a Temporal vMF mixture that captures evolution of clusters in temporal data. For posterior inference, we develop fast variational methods as well as collapsed Gibbs sampling techniques for all three models. Our experiments on six datasets provide strong empirical support in favour of vMF based clustering models over other popular tools such as K-means, Multinomial Mixtures and Latent Dirichlet Allocation.

ICML Conference 2013 Conference Paper

Distributed training of Large-scale Logistic models

  • Siddharth Gopal
  • Yiming Yang 0002

Regularized Multinomial Logistic regression has emerged as one of the most common methods for performing data classification and analysis. With the advent of large-scale data it is common to find scenarios where the number of possible multinomial outcomes is large (in the order of thousands to tens of thousands). In such cases, the computational cost of training logistic models or even simply iterating through all the model parameters is prohibitively expensive. In this paper, we propose a training method for large-scale multinomial logistic models that breaks this bottleneck by enabling parallel optimization of the likelihood objective. Our experiments on large-scale datasets showed an order of magnitude reduction in training time.