Learning Concept-Based Visual Causal Transition and Symbolic Reasoning for Visual Planning

Visual planning simulates how humans make decisions to achieve desired goals in the form of searching for visual causal transitions between an initial visual state and a final visual goal state. It has become increasingly important in egocentric vision with its advantages in guiding agents to perform daily tasks in complex environments. In this paper, we propose an interpretable and generalizable visual planning framework consisting of i) a novel Substitution-based Concept Learner (SCL) that abstracts visual inputs into disentangled concept representations, ii) symbol abstraction and reasoning that performs task planning via the self-learned symbols, and iii) a Visual Causal Transition model (ViCT) that grounds visual causal transitions to semantically similar real-world actions. Given an initial state, we perform goal-conditioned visual planning with a symbolic reasoning method fueled by the learned representations and causal transitions to reach the goal state. To verify the effectiveness of the proposed model, we collect a large-scale visual planning dataset based on AI2-THOR, dubbed as CCTP. Extensive experiments on this challenging dataset demonstrate the superior performance of our method in visual task planning. Empirically, we show that our framework can generalize to unseen task trajectories and unseen object categories.

Molecule Design by Latent Prompt Transformer

This paper proposes a latent prompt Transformer model for solving challenging optimization problems such as molecule design, where the goal is to find molecules with optimal values of a target chemical or biological property that can be computed by an existing software. Our proposed model consists of three components. (1) A latent vector whose prior distribution is modeled by a Unet transformation of a Gaussian white noise vector. (2) A molecule generation model that generates the string-based representation of molecule conditional on the latent vector in (1). We adopt the causal Transformer model that takes the latent vector in (1) as prompt. (3) A property prediction model that predicts the value of the target property of a molecule based on a non-linear regression on the latent vector in (1). We call the proposed model the latent prompt Transformer model. After initial training of the model on existing molecules and their property values, we then gradually shift the model distribution towards the region that supports desired values of the target property for the purpose of molecule design. Our experiments show that our proposed model achieves state of the art performances on several benchmark molecule design tasks.

Learning Energy-Based Prior Model with Diffusion-Amortized MCMC

Latent space Energy-Based Models (EBMs), also known as energy-based priors, have drawn growing interests in the field of generative modeling due to its flexibility in the formulation and strong modeling power of the latent space. However, the common practice of learning latent space EBMs with non-convergent short-run MCMC for prior and posterior sampling is hindering the model from further progress; the degenerate MCMC sampling quality in practice often leads to degraded generation quality and instability in training, especially with highly multi-modal and/or high-dimensional target distributions. To remedy this sampling issue, in this paper we introduce a simple but effective diffusion-based amortization method for long-run MCMC sampling and develop a novel learning algorithm for the latent space EBM based on it. We provide theoretical evidence that the learned amortization of MCMC is a valid long-run MCMC sampler. Experiments on several image modeling benchmark datasets demonstrate the superior performance of our method compared with strong counterparts

Triple Regression for Camera Agnostic Sim2Real Robot Grasping and Manipulation Tasks

Sim2Real (Simulation to Reality) techniques have gained prominence in robotic manipulation and motion planning due to their ability to enhance success rates by enabling agents to test and evaluate various policies and trajectories. In this paper, we investigate the advantages of integrating Sim2Real into robotic frameworks. We introduce the Triple Regression Sim2Real framework, which constructs a real-time digital twin. This twin serves as a replica of reality to simulate and evaluate multiple plans before their execution in real-world scenarios. Our triple regression approach addresses the reality gap by: (1) mitigating projection errors between real and simulated camera perspectives through the first two regression models, and (2) detecting discrepancies in robot control using the third regression model. Experiments on 6-DoF grasp and manipulation tasks (where the gripper can approach from any direction) highlight the effectiveness of our framework. Remarkably, with only RGB input images, our method achieves state-of-the-art success rates. This research advances efficient robot training methods and sets the stage for rapid advancements in robotics and automation.

Sim2Plan: Robot Motion Planning via Message Passing between Simulation and Reality

Simulation-to-real is the task of training and developing machine learning models and deploying them in real settings with minimal additional training. This approach is becoming increasingly popular in fields such as robotics. However, there is often a gap between the simulated environment and the real world, and machine learning models trained in simulation may not perform as well in the real world. We propose a framework that utilizes a message-passing pipeline to minimize the information gap between simulation and reality. The message-passing pipeline is comprised of three modules: scene understanding, robot planning, and performance validation. First, the scene understanding module aims to match the scene layout between the real environment set-up and its digital twin. Then, the robot planning module solves a robotic task through trial and error in the simulation. Finally, the performance validation module varies the planning results by constantly checking the status difference of the robot and object status between the real set-up and the simulation. In the experiment, we perform a case study that requires a robot to make a cup of coffee. Results show that the robot is able to complete the task under our framework successfully. The robot follows the steps programmed into its system and utilizes its actuators to interact with the coffee machine and other tools required for the task. The results of this case study demonstrate the potential benefits of our method that drive robots for tasks that require precision and efficiency. Further research in this area could lead to the development of even more versatile and adaptable robots, opening up new possibilities for automation in various industries.

Calibration-Aware Margin Loss: Pushing the Accuracy-Calibration Consistency Pareto Frontier for Deep Metric Learning

The ability to use the same distance threshold across different test classes / distributions is highly desired for a frictionless deployment of commercial image retrieval systems. However, state-of-the-art deep metric learning losses often result in highly varied intra-class and inter-class embedding structures, making threshold calibration a non-trivial process in practice. In this paper, we propose a novel metric named Operating-Point-Incosistency-Score (OPIS) that measures the variance in the operating characteristics across different classes in a target calibration range, and demonstrate that high accuracy of a metric learning embedding model does not guarantee calibration consistency for both seen and unseen classes. We find that, in the high-accuracy regime, there exists a Pareto frontier where accuracy improvement comes at the cost of calibration consistency. To address this, we develop a novel regularization, named Calibration-Aware Margin (CAM) loss, to encourage uniformity in the representation structures across classes during training. Extensive experiments demonstrate CAM's effectiveness in improving calibration-consistency while retaining or even enhancing accuracy, outperforming state-of-the-art deep metric learning methods.

Learning Joint Latent Space EBM Prior Model for Multi-layer Generator

This paper studies the fundamental problem of learning multi-layer generator models. The multi-layer generator model builds multiple layers of latent variables as a prior model on top of the generator, which benefits learning complex data distribution and hierarchical representations. However, such a prior model usually focuses on modeling inter-layer relations between latent variables by assuming non-informative (conditional) Gaussian distributions, which can be limited in model expressivity. To tackle this issue and learn more expressive prior models, we propose an energy-based model (EBM) on the joint latent space over all layers of latent variables with the multi-layer generator as its backbone. Such joint latent space EBM prior model captures the intra-layer contextual relations at each layer through layer-wise energy terms, and latent variables across different layers are jointly corrected. We develop a joint training scheme via maximum likelihood estimation (MLE), which involves Markov Chain Monte Carlo (MCMC) sampling for both prior and posterior distributions of the latent variables from different layers. To ensure efficient inference and learning, we further propose a variational training scheme where an inference model is used to amortize the costly posterior MCMC sampling. Our experiments demonstrate that the learned model can be expressive in generating high-quality images and capturing hierarchical features for better outlier detection.

Molecule Design by Latent Space Energy-Based Modeling and Gradual Distribution Shifting

Generation of molecules with desired chemical and biological properties such as high drug-likeness, high binding affinity to target proteins, is critical for drug discovery. In this paper, we propose a probabilistic generative model to capture the joint distribution of molecules and their properties. Our model assumes an energy-based model (EBM) in the latent space. Conditional on the latent vector, the molecule and its properties are modeled by a molecule generation model and a property regression model respectively. To search for molecules with desired properties, we propose a sampling with gradual distribution shifting (SGDS) algorithm, so that after learning the model initially on the training data of existing molecules and their properties, the proposed algorithm gradually shifts the model distribution towards the region supported by molecules with desired values of properties. Our experiments show that our method achieves very strong performances on various molecule design tasks.

Diverse and Faithful Knowledge-Grounded Dialogue Generation via Sequential Posterior Inference

The capability to generate responses with diversity and faithfulness using factual knowledge is paramount for creating a human-like, trustworthy dialogue system. Common strategies either adopt a two-step paradigm, which optimizes knowledge selection and response generation separately, and may overlook the inherent correlation between these two tasks, or leverage conditional variational method to jointly optimize knowledge selection and response generation by employing an inference network. In this paper, we present an end-to-end learning framework, termed Sequential Posterior Inference (SPI), capable of selecting knowledge and generating dialogues by approximately sampling from the posterior distribution. Unlike other methods, SPI does not require the inference network or assume a simple geometry of the posterior distribution. This straightforward and intuitive inference procedure of SPI directly queries the response generation model, allowing for accurate knowledge selection and generation of faithful responses. In addition to modeling contributions, our experimental results on two common dialogue datasets (Wizard of Wikipedia and Holl-E) demonstrate that SPI outperforms previous strong baselines according to both automatic and human evaluation metrics.

Learning for Open-World Calibration with Graph Neural Networks

We tackle the problem of threshold calibration for open-world recognition by incorporating representation compactness measures into clustering. Unlike the open-set recognition which focuses on discovering and rejecting the unknown, open-world recognition learns robust representations that are generalizable to disjoint unknown classes at test time. Our proposed method is based on two key observations: (i) representation structures among neighbouring images in high dimensional visual embedding spaces have strong self-similarity which can be leveraged to encourage transferability to the open world, (ii) intra-class embedding structures can be modeled with the marginalized von Mises-Fisher (vMF) probability, whose correlation with the true positive rate is dataset-invariant. Motivated by these, we design a unified framework centered around a graph neural network (GNN) to jointly predict the pseudo-labels and the vMF concentrations which indicate the representation compactness. These predictions can be converted into statistical estimations for recognition accuracy, allowing more robust calibration of the distance threshold to achieve target utility for the open-world classes. Results on a variety of visual recognition benchmarks demonstrate the superiority of our method over traditional posthoc calibration methods for the open world, especially under distribution shift.