Universal Neural Functionals

A challenging problem in many modern machine learning tasks is to process weight-space features, i.e., to transform or extract information from the weights and gradients of a neural network. Recent works have developed promising weight-space models that are equivariant to the permutation symmetries of simple feedforward networks. However, they are not applicable to general architectures, since the permutation symmetries of a weight space can be complicated by recurrence or residual connections. This work proposes an algorithm that automatically constructs permutation equivariant models, which we refer to as universal neural functionals (UNFs), for any weight space. Among other applications, we demonstrate how UNFs can be substituted into existing learned optimizer designs, and find promising improvements over prior methods when optimizing small image classifiers and language models. Our results suggest that learned optimizers can benefit from considering the (symmetry) structure of the weight space they optimize. We open-source our library for constructing UNFs at https://github.com/AllanYangZhou/universal_neural_functional.

AutoFT: Robust Fine-Tuning by Optimizing Hyperparameters on OOD Data

Foundation models encode rich representations that can be adapted to a desired task by fine-tuning on task-specific data. However, fine-tuning a model on one particular data distribution often compromises the model's original performance on other distributions. Current methods for robust fine-tuning utilize hand-crafted regularization techniques to constrain the fine-tuning process towards the base foundation model. Yet, it is hard to precisely specify what characteristics of the foundation model to retain during fine-tuning, as this depends on how the pre-training, fine-tuning, and evaluation data distributions relate to each other. We propose AutoFT, a data-driven approach for guiding foundation model fine-tuning. AutoFT optimizes fine-tuning hyperparameters to maximize performance on a small out-of-distribution (OOD) validation set. To guide fine-tuning in a granular way, AutoFT searches a highly expressive hyperparameter space that includes weight coefficients for many different losses, in addition to learning rate and weight decay values. We evaluate AutoFT on nine natural distribution shifts which include domain shifts and subpopulation shifts. Our experiments show that AutoFT significantly improves generalization to new OOD data, outperforming existing robust fine-tuning methods. Notably, AutoFT achieves new state-of-the-art performance on the WILDS-iWildCam and WILDS-FMoW benchmarks, outperforming the previous best methods by $6.0\%$ and $1.5\%$, respectively.

Neural Processing of Tri-Plane Hybrid Neural Fields

Driven by the appealing properties of neural fields for storing and communicating 3D data, the problem of directly processing them to address tasks such as classification and part segmentation has emerged and has been investigated in recent works. Early approaches employ neural fields parameterized by shared networks trained on the whole dataset, achieving good task performance but sacrificing reconstruction quality. To improve the latter, later methods focus on individual neural fields parameterized as large Multi-Layer Perceptrons (MLPs), which are, however, challenging to process due to the high dimensionality of the weight space, intrinsic weight space symmetries, and sensitivity to random initialization. Hence, results turn out significantly inferior to those achieved by processing explicit representations, e.g., point clouds or meshes. In the meantime, hybrid representations, in particular based on tri-planes, have emerged as a more effective and efficient alternative to realize neural fields, but their direct processing has not been investigated yet. In this paper, we show that the tri-plane discrete data structure encodes rich information, which can be effectively processed by standard deep-learning machinery. We define an extensive benchmark covering a diverse set of fields such as occupancy, signed/unsigned distance, and, for the first time, radiance fields. While processing a field with the same reconstruction quality, we achieve task performance far superior to frameworks that process large MLPs and, for the first time, almost on par with architectures handling explicit representations.

Fleet Policy Learning via Weight Merging and An Application to Robotic Tool-Use

Fleets of robots ingest massive amounts of streaming data generated by interacting with their environments, far more than those that can be stored or transmitted with ease. At the same time, we hope that teams of robots can co-acquire diverse skills through their experiences in varied settings. How can we enable such fleet-level learning without having to transmit or centralize fleet-scale data? In this paper, we investigate distributed learning of policies as a potential solution. To efficiently merge policies in the distributed setting, we propose fleet-merge, an instantiation of distributed learning that accounts for the symmetries that can arise in learning policies that are parameterized by recurrent neural networks. We show that fleet-merge consolidates the behavior of policies trained on 50 tasks in the Meta-World environment, with the merged policy achieving good performance on nearly all training tasks at test time. Moreover, we introduce a novel robotic tool-use benchmark, fleet-tools, for fleet policy learning in compositional and contact-rich robot manipulation tasks, which might be of broader interest, and validate the efficacy of fleet-merge on the benchmark.

Simple Embodied Language Learning as a Byproduct of Meta-Reinforcement Learning

Whereas machine learning models typically learn language by directly training on language tasks (e.g., next-word prediction), language emerges in human children as a byproduct of solving non-language tasks (e.g., acquiring food). Motivated by this observation, we ask: can embodied reinforcement learning (RL) agents also indirectly learn language from non-language tasks? Learning to associate language with its meaning requires a dynamic environment with varied language. Therefore, we investigate this question in a multi-task environment with language that varies across the different tasks. Specifically, we design an office navigation environment, where the agent's goal is to find a particular office, and office locations differ in different buildings (i.e., tasks). Each building includes a floor plan with a simple language description of the goal office's location, which can be visually read as an RGB image when visited. We find RL agents indeed are able to indirectly learn language. Agents trained with current meta-RL algorithms successfully generalize to reading floor plans with held-out layouts and language phrases, and quickly navigate to the correct office, despite receiving no direct language supervision.

Just Ask for Calibration: Strategies for Eliciting Calibrated Confidence Scores from Language Models Fine-Tuned with Human Feedback

A trustworthy real-world prediction system should be well-calibrated; that is, its confidence in an answer is indicative of the likelihood that the answer is correct, enabling deferral to a more expensive expert in cases of low-confidence predictions. While recent studies have shown that unsupervised pre-training produces large language models (LMs) that are remarkably well-calibrated, the most widely-used LMs in practice are fine-tuned with reinforcement learning with human feedback (RLHF-LMs) after the initial unsupervised pre-training stage, and results are mixed as to whether these models preserve the well-calibratedness of their ancestors. In this paper, we conduct a broad evaluation of computationally feasible methods for extracting confidence scores from LLMs fine-tuned with RLHF. We find that with the right prompting strategy, RLHF-LMs verbalize probabilities that are much better calibrated than the model's conditional probabilities, enabling fairly well-calibrated predictions. Through a combination of prompting strategy and temperature scaling, we find that we can reduce the expected calibration error of RLHF-LMs by over 50%.

Neural Functional Transformers

The recent success of neural networks as implicit representation of data has driven growing interest in neural functionals: models that can process other neural networks as input by operating directly over their weight spaces. Nevertheless, constructing expressive and efficient neural functional architectures that can handle high-dimensional weight-space objects remains challenging. This paper uses the attention mechanism to define a novel set of permutation equivariant weight-space layers and composes them into deep equivariant models called neural functional Transformers (NFTs). NFTs respect weight-space permutation symmetries while incorporating the advantages of attention, which have exhibited remarkable success across multiple domains. In experiments processing the weights of feedforward MLPs and CNNs, we find that NFTs match or exceed the performance of prior weight-space methods. We also leverage NFTs to develop Inr2Array, a novel method for computing permutation invariant latent representations from the weights of implicit neural representations (INRs). Our proposed method improves INR classification accuracy by up to $+17\%$ over existing methods. We provide an implementation of our layers at https://github.com/AllanYangZhou/nfn.

Permutation Equivariant Neural Functionals

This work studies the design of neural networks that can process the weights or gradients of other neural networks, which we refer to as neural functional networks (NFNs). Despite a wide range of potential applications, including learned optimization, processing implicit neural representations, network editing, and policy evaluation, there are few unifying principles for designing effective architectures that process the weights of other networks. We approach the design of neural functionals through the lens of symmetry, in particular by focusing on the permutation symmetries that arise in the weights of deep feedforward networks because hidden layer neurons have no inherent order. We introduce a framework for building permutation equivariant neural functionals, whose architectures encode these symmetries as an inductive bias. The key building blocks of this framework are NF-Layers (neural functional layers) that we constrain to be permutation equivariant through an appropriate parameter sharing scheme. In our experiments, we find that permutation equivariant neural functionals are effective on a diverse set of tasks that require processing the weights of MLPs and CNNs, such as predicting classifier generalization, producing "winning ticket" sparsity masks for initializations, and editing the weights of implicit neural representations (INRs). In addition, we provide code for our models and experiments at https://github.com/AllanYangZhou/nfn.

NeRF in the Palm of Your Hand: Corrective Augmentation for Robotics via Novel-View Synthesis

Expert demonstrations are a rich source of supervision for training visual robotic manipulation policies, but imitation learning methods often require either a large number of demonstrations or expensive online expert supervision to learn reactive closed-loop behaviors. In this work, we introduce SPARTN (Synthetic Perturbations for Augmenting Robot Trajectories via NeRF): a fully-offline data augmentation scheme for improving robot policies that use eye-in-hand cameras. Our approach leverages neural radiance fields (NeRFs) to synthetically inject corrective noise into visual demonstrations, using NeRFs to generate perturbed viewpoints while simultaneously calculating the corrective actions. This requires no additional expert supervision or environment interaction, and distills the geometric information in NeRFs into a real-time reactive RGB-only policy. In a simulated 6-DoF visual grasping benchmark, SPARTN improves success rates by 2.8$\times$ over imitation learning without the corrective augmentations and even outperforms some methods that use online supervision. It additionally closes the gap between RGB-only and RGB-D success rates, eliminating the previous need for depth sensors. In real-world 6-DoF robotic grasping experiments from limited human demonstrations, our method improves absolute success rates by $22.5\%$ on average, including objects that are traditionally challenging for depth-based methods. See video results at \url{https://bland.website/spartn}.

Unsupervised language models for disease variant prediction

There is considerable interest in predicting the pathogenicity of protein variants in human genes. Due to the sparsity of high quality labels, recent approaches turn to \textit{unsupervised} learning, using Multiple Sequence Alignments (MSAs) to train generative models of natural sequence variation within each gene. These generative models then predict variant likelihood as a proxy to evolutionary fitness. In this work we instead combine this evolutionary principle with pretrained protein language models (LMs), which have already shown promising results in predicting protein structure and function. Instead of training separate models per-gene, we find that a single protein LM trained on broad sequence datasets can score pathogenicity for any gene variant zero-shot, without MSAs or finetuning. We call this unsupervised approach \textbf{VELM} (Variant Effect via Language Models), and show that it achieves scoring performance comparable to the state of the art when evaluated on clinically labeled variants of disease-related genes.