feature construction
Embedding Domain-Specific Knowledge from LLMs into the Feature Engineering Pipeline
Feature engineering is mandatory in the machine learning pipeline to obtain robust models. While evolutionary computation is well-known for its great results both in feature selection and feature construction, its methods are computationally expensive due to the large number of evaluations required to induce the final model. Part of the reason why these algorithms require a large number of evaluations is their lack of domain-specific knowledge, resulting in a lot of random guessing during evolution. In this work, we propose using Large Language Models (LLMs) as an initial feature construction step to add knowledge to the dataset. By doing so, our results show that the evolution can converge faster, saving us computational resources. The proposed approach only provides the names of the features in the dataset and the target objective to the LLM, making it usable even when working with datasets containing private data. While consistent improvements to test performance were only observed for one-third of the datasets (CSS, PM, and IM10), possibly due to problems being easily explored by LLMs, this approach only decreased the model performance in 1/77 test cases. Additionally, this work introduces the M6GP feature engineering algorithm to symbolic regression, showing it can improve the results of the random forest regressor and produce competitive results with its predecessor, M3GP.
Linear Feature Encoding for Reinforcement Learning
Feature construction is of vital importance in reinforcement learning, as the quality of a value function or policy is largely determined by the corresponding features. Typical deep RL approaches use a linear output layer, which means that deep RL can be interpreted as a feature construction/encoding network followed by linear value function approximation. This paper develops and evaluates a theory of linear feature encoding. We extend theoretical results on feature quality for linear value function approximation from the uncontrolled case to the controlled case. We then develop a supervised linear feature encoding method that is motivated by insights from linear value function approximation theory, as well as empirical successes from deep RL.
Sharpness-Aware Minimization for Evolutionary Feature Construction in Regression
Zhang, Hengzhe, Chen, Qi, Xue, Bing, Banzhaf, Wolfgang, Zhang, Mengjie
In recent years, genetic programming (GP)-based evolutionary feature construction has achieved significant success. However, a primary challenge with evolutionary feature construction is its tendency to overfit the training data, resulting in poor generalization on unseen data. In this research, we draw inspiration from PAC-Bayesian theory and propose using sharpness-aware minimization in function space to discover symbolic features that exhibit robust performance within a smooth loss landscape in the semantic space. By optimizing sharpness in conjunction with cross-validation loss, as well as designing a sharpness reduction layer, the proposed method effectively mitigates the overfitting problem of GP, especially when dealing with a limited number of instances or in the presence of label noise. Experimental results on 58 real-world regression datasets show that our approach outperforms standard GP as well as six state-of-the-art complexity measurement methods for GP in controlling overfitting. Furthermore, the ensemble version of GP with sharpness-aware minimization demonstrates superior performance compared to nine fine-tuned machine learning and symbolic regression algorithms, including XGBoost and LightGBM.
Automatic Feature Engineering for Time Series Classification: Evaluation and Discussion
Renault, Aurélien, Bondu, Alexis, Lemaire, Vincent, Gay, Dominique
Time Series Classification (TSC) has received much attention in the past two decades and is still a crucial and challenging problem in data science and knowledge engineering. Indeed, along with the increasing availability of time series data, many TSC algorithms have been suggested by the research community in the literature. Besides state-of-the-art methods based on similarity measures, intervals, shapelets, dictionaries, deep learning methods or hybrid ensemble methods, several tools for extracting unsupervised informative summary statistics, aka features, from time series have been designed in the recent years. Originally designed for descriptive analysis and visualization of time series with informative and interpretable features, very few of these feature engineering tools have been benchmarked for TSC problems and compared with state-of-the-art TSC algorithms in terms of predictive performance. In this article, we aim at filling this gap and propose a simple TSC process to evaluate the potential predictive performance of the feature sets obtained with existing feature engineering tools. Thus, we present an empirical study of 11 feature engineering tools branched with 9 supervised classifiers over 112 time series data sets. The analysis of the results of more than 10000 learning experiments indicate that feature-based methods perform as accurately as current state-of-the-art TSC algorithms, and thus should rightfully be considered further in the TSC literature.
Dense Sample Deep Learning
Hanson, Stephen Josè, Yadav, Vivek, Hanson, Catherine
Deep Learning (DL) , a variant of the neural network algorithms originally proposed in the 1980s, has made surprising progress in Artificial Intelligence (AI), ranging from language translation, protein folding, autonomous cars, and more recently human-like language models (CHATbots), all that seemed intractable until very recently. Despite the growing use of Deep Learning (DL) networks, little is actually understood about the learning mechanisms and representations that makes these networks effective across such a diverse range of applications. Part of the answer must be the huge scale of the architecture and of course the large scale of the data, since not much has changed since 1987. But the nature of deep learned representations remain largely unknown. Unfortunately training sets with millions or billions of tokens have unknown combinatorics and Networks with millions or billions of hidden units cannot easily be visualized and their mechanisms cannot be easily revealed. In this paper, we explore these questions with a large (1.24M weights; VGG) DL in a novel high density sample task (5 unique tokens with at minimum 500 exemplars per token) which allows us to more carefully follow the emergence of category structure and feature construction. We use various visualization methods for following the emergence of the classification and the development of the coupling of feature detectors and structures that provide a type of graphical bootstrapping, From these results we harvest some basic observations of the learning dynamics of DL and propose a new theory of complex feature construction based on our results.
A technical note on bilinear layers for interpretability
The ability of neural networks to represent more features than neurons makes interpreting them challenging. This phenomenon, known as superposition, has spurred efforts to find architectures that are more interpretable than standard multilayer perceptrons (MLPs) with elementwise activation functions. In this note, I examine bilinear layers, which are a type of MLP layer that are mathematically much easier to analyze while simultaneously performing better than standard MLPs. Although they are nonlinear functions of their input, I demonstrate that bilinear layers can be expressed using only linear operations and third order tensors. We can integrate this expression for bilinear layers into a mathematical framework for transformer circuits, which was previously limited to attention-only transformers. These results suggest that bilinear layers are easier to analyze mathematically than current architectures and thus may lend themselves to deeper safety insights by allowing us to talk more formally about circuits in neural networks. Additionally, bilinear layers may offer an alternative path for mechanistic interpretability through understanding the mechanisms of feature construction instead of enumerating a (potentially exponentially) large number of features in large models.
Feature Construction for Inverse Reinforcement Learning
The goal of inverse reinforcement learning is to find a reward function for a Markov decision process, given example traces from its optimal policy. Current IRL techniques generally rely on user-supplied features that form a concise basis for the reward. We present an algorithm that instead constructs reward features from a large collection of component features, by building logical conjunctions of those component features that are relevant to the example policy. Given example traces, the algorithm returns a reward function as well as the constructed features. The reward function can be used to recover a full, deterministic, stationary policy, and the features can be used to transplant the reward function into any novel environment on which the component features are well defined.