Scalable Kernel Inverse Optimization

Inverse Optimization (IO) is a framework for learning the unknown objective function of an expert decision-maker from a past dataset. In this paper, we extend the hypothesis class of IO objective functions to a reproducing kernel Hilbert space (RKHS), thereby enhancing feature representation to an infinite-dimensional space. We demonstrate that a variant of the representer theorem holds for a specific training loss, allowing the reformulation of the problem as a finite-dimensional convex optimization program. To address scalability issues commonly associated with kernel methods, we propose the Sequential Selection Optimization (SSO) algorithm to efficiently train the proposed Kernel Inverse Optimization (KIO) model. Finally, we validate the generalization capabilities of the proposed KIO model and the effectiveness of the SSO algorithm through learning-from-demonstration tasks on the MuJoCo benchmark.

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Peer review

Reviewer o6JR6/10 · confidence 2/52024-07-03

Summary

The paper presents an innovative approach to inverse optimization using kernel methods. Inverse optimization (IO) aims to learn the unknown objective function of an expert decision-maker from past data by determining the optimization goal given the optimal solution, which is the reverse of traditional optimization. The authors extend the hypothesis class of IO objective functions to a reproducing kernel Hilbert space (RKHS), thereby enhancing features to an infinite-dimensional space. They demonstrate a variant of the representer theorem for a specific training loss, reformulating the problem to a finite-dimensional convex optimization. To address scalability issues with kernel methods, the paper proposes the Sequential Selection Optimization (SSO) algorithm, which selectively optimizes components of the decision variable, improving efficiency and scalability while ensuring convergence to the same solution as the KIO model. The KIO model's generalization capabilities and the SSO algorithm's effectiveness are validated through learning-from-demonstration tasks within the MuJoCo benchmark.

Strengths

The inverse optimization is extended to the Reproducing Kernel Hilbert Space (RKHS), which improves the complexity and expressiveness of the objective function. This innovative method can handle more complex decision problems. The sequential selection optimization (SSO) algorithm is proposed to solve the scalability problem of the kernel method. The SSO algorithm improves the training efficiency of the model and enables the KIO model to process large-scale data sets. The article not only proves the effectiveness of the KIO model in theory, but also verifies its practical application effect through the learning demonstration task in the MuJoCo benchmark, demonstrating the generalization ability of the model.

Weaknesses

The nonlinear and high-dimensional nature of kernel methods makes the models less interpretable. A clear understanding and interpretation of the optimization model may be required. The performance of the KIO model depends on the selection of kernel functions and hyperparameters. Different kernel functions and hyperparameter settings can significantly affect the results and often need to be adjusted through methods such as cross-validation, which increases the complexity of model training. So I hope the author can add more details in this part

Questions

Inverse optimization methods require high-quality demonstration data to learn the target function. If there is noise or error in the demonstration data, what impact will this have on the effectiveness of the article? How to overcome this defect, because obtaining high-quality data may not be so easy

Rating

6

Confidence

2

Soundness

3

Presentation

2

Contribution

3

Limitations

yes

Reviewer tcjN6/10 · confidence 3/52024-07-04

Summary

This paper extend the hypothesis class of Inverse Optimization functions to RKHSs, there by the feature mappings could lie in a infinite dimensional space. This paper also discuss about the scalability issue and then proposed a SSO algorithm to the proposed KIO model.

Strengths

Clarity: This paper is well-written and easy to follow. This paper investigates the kernel method into the existing IO framework. This paper also provides the SSO method for scalability, heuristic for choosing coordinates and warm-up trick. This brings some new insights to the optimization community.

Weaknesses

The choice of kernels is usually problem-dependent. It will be better to discuss some different types of kernels. Besides, the hyperparameter tuning of kernels should be reported. Please report the standard deviation in the experiments.

Questions

None.

Rating

6

Confidence

3

Soundness

3

Presentation

3

Contribution

3

Limitations

None.

Reviewer 9Go27/10 · confidence 4/52024-07-13

Summary

This paper concerns the topic of Inverse Optimization (IO) which deals with learning the objective function of the decision maker given previous data from an expert decision maker. By kernelizing the objective function, they extend the framework to features from a potentially infinite-dimensional space. The main contributions of this paper is a scalable SDP formulation of the kernel inverse optimization problem and a Sequential Selection Optimization algorithm that works by selecting a batch of variables at random or according to a KKT-based heuristic to optimizer over. The effectiveness of the SSO algorithm is shown using experimentally using imitation learning tasks from the MuJoCo benchmark.

Strengths

The mains strength of this paper is the presentation of a scalable SDP formulation of the kernel optimization problem and a thorough experimental evaluation across a variety of MuJoCo benchmark tasks which includes an ablation study to evaluate different combinations of variable selection and warm-up strategies.

Weaknesses

The main weakness is the lack of convergence guarantees for Sequential Selection Optimization (SSO) algorithm for the given different variable selection strategies. However, this is not a major drawback as the main contribution is a scalable SDP formulation for the kernel inverse optimization problem. The authors used Gaussian kernel for all experiments but it would be good to have more discussion about how type of kernel influences the performance of the SSO algorithm or quality of the solutions. There is also a lack of detail about how the baseline methods BC(TD3+BC) and BC(CQL) and Teacher were evaluated (e.g. hyperparameters, amount of data used and number of iterations to converge). There is a lack of convergence plots for SSO and other baselines in Table 1 and 2.

Questions

1. In Section 4.2, how does one concatenate the optimal solutions of the n solved small problems to form an initial guess? Have you evaluated different possible ways to form an initial guess? 2. Have you considered evaluating your SSO algorithm on different types of kernel functions? 3. For Table 1, you report only the amount of data the KIO+SSO method used but you didn't report how much data the BC(TD3+BC) and BC(CQL) offline reinforcement learning algorithms used. Is there a reason for this? 4. For Table 1, why are the scores for IO so uniformly low compared to KIO? Is it possible that IO and KIO may perform similarly in simpler imitation learning tasks? 5. For Table 2, it is quite interesting to see that SCS and SSO converged to more or less the same objective value and it would be interesting to see how many iterations (and time) it took for SCS to converge vs. how many iterations for SSO to converge. This could be better represented in a plot. The convergence could be bad in the beginning due to low quality of the initial guess and then improve as the algorithm converges. Its fairly obvious that the scores will be the same range for all trials if the objective value is the same, so it doesn't help to report objective value and score side-by-side. 6. Have you considered reporting the speed of convergence for KIO + SSO method vs. BC(TD3+BC) and BC(CQL) offline reinforcement learning algorithms in terms of a plot of objective value vs. # of iterations or objective value vs. time?

Rating

7

Confidence

4

Soundness

3

Presentation

3

Contribution

3

Limitations

The authors acknowledge the limitations of their work, which are (1) lack of convergence guarantees for Sequential Selection Optimization (SSO) algorithm for the given different variable selection strategies and (2) the large memory requirements.

Reviewer 9Go22024-08-12

I would like to thank the authors for their detailed answers to my comments and questions. Good to see that an experimental comparison of different kernel types: linear, RBF and Gaussian and for clarifying about the dataset size. I would suggest that the mentioned experiments regarding different initialization strategies be added to the paper in a table, just to show that it has been considered, and to say that extensive experimentation with initialization strategies is subject of future work. If submitting elsewhere, I would suggest also trying KIO with simpler tasks where IO performs reasonably well for two reasons: (1) it increases the range of experiments, strengthening the paper and showing how performance of KIO varies with complexity of the tasks and (2) it makes it look less suspicious since any reader may ask why scores for IO are uniformly lower. For now, simply mentioning that IO may be competitive in simpler tasks is sufficient. My concerns have been sufficiently addressed and I would like to raise my score to 7 (Accept).

Authorsrebuttal2024-08-12

We thank the reviewer for their valuable comments and suggestions. We will include a table comparing the initialization strategies alongside the table comparing different kernels in the updated version of the manuscript. We also agree that extending our simulations to include simpler tasks in our numerical study would help us demonstrate the performance gap between KIO and IO across varying levels of task complexity. We will add a discussion regarding why IO performs uniformly lower than KIO in the updated version of the manuscript. Based on the reviewer's suggestions, we will make these numerical extensions part of our future work to provide a more comprehensive study of KIO. Just a side note regarding the grade: It appears to us your grade has not yet been updated in the system (it is still 5, whereas we can see the updated grades of the other two reviewers). We are not sure whether there is a system issue or if you plan to change it later. We wish to bring it to your attention just in case.

Authorsrebuttal2024-08-12

We thank all the reviewers for their valuable feedback and swift reaction to our responses. Based on the feedback, we will make the following adjustments in the updated version of the manuscript: - Add the numerical study regarding different kernel functions. - Add the discussion on alternative initialization strategies. - Add comments on the performance gap between KIO and IO. - Add a discussion and a table, as provided in the global rebuttal, on the robustness of KIO under various noise types and levels.

Program Chairsdecision2024-09-25

Decision

Accept (poster)

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