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Publications
Latent Variable Sequential Set Transformers for Joint Multi-Agent Motion Prediction
Robust multi-agent trajectory prediction is essential for the safe control of robotic systems. A major challenge is to efficiently learn a r… (see more)epresentation that approximates the true joint distribution of contextual, social, and temporal information to enable planning. We propose Latent Variable Sequential Set Transformers which are encoder-decoder architectures that generate scene-consistent multi-agent trajectories. We refer to these architectures as “AutoBots”. The encoder is a stack of interleaved temporal and social multi-head self-attention (MHSA) modules which alternately perform equivariant processing across the temporal and social dimensions. The decoder employs learnable seed parameters in combination with temporal and social MHSA modules allowing it to perform inference over the
entire future scene in a single forward pass efficiently. AutoBots can produce either the trajectory of one ego-agent or a distribution over the future trajectories for all agents in the scene. For the single-agent prediction case, our model achieves top results on the global nuScenes vehicle motion prediction leaderboard, and produces strong results on the Argoverse vehicle prediction challenge. In the multi-agent setting, we evaluate on the synthetic partition of TrajNet++ dataset to showcase the model’s socially-consistent predictions. We also demonstrate our model on general sequences of sets and provide illustrative experiments modelling the sequential structure of the multiple strokes that make up symbols in the Omniglot data. A distinguishing feature of AutoBots is that all models are trainable on a
single desktop GPU (1080 Ti) in under 48h.
Among attempts at giving a theoretical account of the success of deep neural networks, a recent line of work has identified a so-called `laz… (see more)y' training regime in which the network can be well approximated by its linearization around initialization. Here we investigate the comparative effect of the lazy (linear) and feature learning (non-linear) regimes on subgroups of examples based on their difficulty. Specifically, we show that easier examples are given more weight in feature learning mode, resulting in faster training compared to more difficult ones. In other words, the non-linear dynamics tends to sequentialize the learning of examples of increasing difficulty. We illustrate this phenomenon across different ways to quantify example difficulty, including c-score, label noise, and in the presence of easy-to-learn spurious correlations. Our results reveal a new understanding of how deep networks prioritize resources across example difficulty.
Dequantisation is a general technique used for transforming data described by a discrete random variable x into a continuous (latent) random… (see more) variable z, for the purpose of it being modeled by likelihood-based density models. Dequantisation was first introduced in the context of ordinal data, such as image pixel values. However, when the data is categorical, the dequantisation scheme is not obvious. We learn such a dequantisation scheme q(z|x), using variational inference with TRUncated FLows (TRUFL) — a novel flow-based model that allows the dequantiser to have a learnable truncated support. Unlike previous work, the TRUFL dequantiser is (i) capable of embedding the data losslessly in certain cases, since the truncation allows the conditional distributions q(z|x) to have non-overlapping bounded supports, while being (ii) trainable with back-propagation. Addtionally, since the support of the marginal q(z) is bounded and the support of prior p(z) is not, we propose to renormalise the prior distribution over the support of q(z). We derive a lower bound for training, and propose a rejection sampling scheme to account for the invalid samples. Experimentally, we benchmark TRUFL on constrained generation tasks, and find that it outperforms prior approaches. In addition, we find that rejection sampling results in higher validity for the constrained problems.
2022-01-01
International Conference on Learning Representations (published)
We propose an analysis in fair learning that preserves the utility of the data while reducing prediction disparities under the criteria of g… (see more)roup sufficiency. We focus on the scenario where the data contains multiple or even many subgroups, each with limited number of samples. As a result, we present a principled method for learning a fair predictor for all subgroups via formulating it as a bilevel objective. Specifically, the subgroup specific predictors are learned in the lower-level through a small amount of data and the fair predictor. In the upper-level, the fair predictor is updated to be close to all subgroup specific predictors. We further prove that such a bilevel objective can effectively control the group sufficiency and generalization error. We evaluate the proposed framework on real-world datasets. Empirical evidence suggests the consistently improved fair predictions, as well as the comparable accuracy to the baselines.
Non-negative tensor factorization has been shown a practical solution to automatically discover phenotypes from the electronic health record… (see more)s (EHR) with minimal human supervision. Such methods generally require an input tensor describing the inter-modal interactions to be pre-established; however, the correspondence between different modalities (e.g., correspondence between medications and diagnoses) can often be missing in practice. Although heuristic methods can be applied to estimate them, they inevitably introduce errors, and leads to sub-optimal phenotype quality. This is particularly important for patients with complex health conditions (e.g., in critical care) as multiple diagnoses and medications are simultaneously present in the records. To alleviate this problem and discover phenotypes from EHR with unobserved inter-modal correspondence, we propose the collective hidden interaction tensor factorization (cHITF) to infer the correspondence between multiple modalities jointly with the phenotype discovery. We assume that the observed matrix for each modality is marginalization of the unobserved inter-modal correspondence, which are reconstructed by maximizing the likelihood of the observed matrices. Extensive experiments conducted on the real-world MIMIC-III dataset demonstrate that cHITF effectively infers clinically meaningful inter-modal correspondence, discovers phenotypes that are more clinically relevant and diverse, and achieves better predictive performance compared with a number of state-of-the-art computational phenotyping models.
2022-01-01
IEEE Transactions on Knowledge and Data Engineering (published)
In this article, we work on a sound recognition system that continually incorporates new sound classes. Our main goal is to develop a framew… (see more)ork where the model can be updated without relying on labeled data. For this purpose, we propose adopting representation learning, where an encoder is trained using unlabeled data. This learning framework enables the study and implementation of a practically relevant use case where only a small amount of the labels is available in a continual learning context. We also make the empirical observation that a similarity-based representation learning method within this framework is robust to forgetting even if no explicit mechanism against forgetting is employed. We show that this approach obtains similar performance compared to several distillation-based continual learning methods when employed on self-supervised representation learning methods.
Taxonomies have been widely used in various domains to underpin numerous applications. Specially, product taxonomies serve an essential role… (see more) in the e-commerce domain for the recommendation, browsing, and query understanding. However, taxonomies need to constantly capture the newly emerged terms or concepts in e-commerce platforms to keep up-to-date, which is expensive and labor-intensive if it relies on manual maintenance and updates. Therefore, we target the taxonomy expansion task to attach new concepts to existing taxonomies automatically. In this paper, we present a self-supervised and user behavior-oriented product taxonomy expansion framework to append new concepts into existing taxonomies. Our framework extracts hyponymy relations that conform to users' intentions and cognition. Specifically, i) to fully exploit user behavioral information, we extract candidate hyponymy relations that match user interests from query-click concepts; ii) to enhance the semantic information of new concepts and better detect hyponymy relations, we model concepts and relations through both user-generated content and structural information in existing taxonomies and user click logs, by leveraging Pre-trained Language Models and Graph Neural Network combined with Contrastive Learning; iii) to reduce the cost of dataset construction and overcome data skews, we construct a high-quality and balanced training dataset from existing taxonomy with no supervision. Extensive experiments on real-world product taxonomies in Meituan Platform, a leading Chinese vertical e-commerce platform to order take-out with more than 70 million daily active users, demonstrate the superiority of our proposed framework over state-of-the-art methods. Notably, our method enlarges the size of real-world product taxonomies from 39,263 to 94,698 relations with 88% precision. Our implementation is available: https://github.com/AdaCheng/Product_Taxonomy_Expansion.
Graph Neural Networks (GNNs) that are based on the message passing (MP) paradigm generally exchange information between 1-hop neighbors to b… (see more)uild node representations at each layer. In principle, such networks are not able to capture long-range interactions (LRI) that may be desired or necessary for learning a given task on graphs. Recently, there has been an increasing interest in development of Transformer-based methods for graphs that can consider full node connectivity beyond the original sparse structure, thus enabling the modeling of LRI. However, MP-GNNs that simply rely on 1-hop message passing often fare better in several existing graph benchmarks when combined with positional feature representations, among other innovations, hence limiting the perceived utility and ranking of Transformer-like architectures. Here, we present the Long Range Graph Benchmark (LRGB) with 5 graph learning datasets: PascalVOC-SP, COCO-SP, PCQM-Contact, Peptides-func and Peptides-struct that arguably require LRI reasoning to achieve strong performance in a given task. We benchmark both baseline GNNs and Graph Transformer networks to verify that the models which capture long-range dependencies perform significantly better on these tasks. Therefore, these datasets are suitable for benchmarking and exploration of MP-GNNs and Graph Transformer architectures that are intended to capture LRI.
Video prediction is a challenging task. The quality of video frames from current state-of-the-art (SOTA) generative models tends to be poor … (see more)and generalization beyond the training data is difficult. Furthermore, existing prediction frameworks are typically not capable of simultaneously handling other video-related tasks such as unconditional generation or interpolation. In this work, we devise a general-purpose framework called Masked Conditional Video Diffusion (MCVD) for all of these video synthesis tasks using a probabilistic conditional score-based denoising diffusion model, conditioned on past and/or future frames. We train the model in a manner where we randomly and independently mask all the past frames or all the future frames. This novel but straightforward setup allows us to train a single model that is capable of executing a broad range of video tasks, specifically: future/past prediction -- when only future/past frames are masked; unconditional generation -- when both past and future frames are masked; and interpolation -- when neither past nor future frames are masked. Our experiments show that this approach can generate high-quality frames for diverse types of videos. Our MCVD models are built from simple non-recurrent 2D-convolutional architectures, conditioning on blocks of frames and generating blocks of frames. We generate videos of arbitrary lengths autoregressively in a block-wise manner. Our approach yields SOTA results across standard video prediction and interpolation benchmarks, with computation times for training models measured in 1-12 days using
Retrosynthetic planning plays a critical role in drug discovery and organic chemistry. Starting from a target molecule as the root node, it … (see more)aims to find a complete reaction tree subject to the constraint that all leaf nodes belong to a set of starting materials. The multi-step reactions are crucial because they determine the flow chart in the production of the Organic Chemical Industry. However, existing datasets lack curation of tree-structured multi-step reactions, and fail to provide such reaction trees, limiting models’ understanding of organic molecule transformations. In this work, we first develop a benchmark curated for the retrosynthetic planning task, which consists of 124,869 reaction trees retrieved from the public USPTO-full dataset. On top of that, we propose Metro: Memory-Enhanced Transformer for RetrOsynthetic planning. Specifically, the dependency among molecules in the reaction tree is captured as context information for multi-step retrosynthesis predictions through transformers with a memory module. Extensive experiments show that Metro dramatically outperforms existing single-step retrosynthesis models by at least 10.7% in top-1 accuracy. The experiments demonstrate the superiority of exploiting context information in the retrosynthetic planning task. Moreover, the proposed model can be directly used for synthetic accessibility analysis, as it is trained on reaction trees with the shortest depths. Our work is the first step towards a brand new formulation for retrosynthetic planning in the aspects of data construction, model design, and evaluation. Code is available at https://github.com/SongtaoLiu0823/metro.
