Optimal Decision Tree Pruning Revisited: Algorithms and Complexity

We present a comprehensive classical and parameterized complexity analysis of decision tree pruning operations, extending recent research on the complexity of learning small decision trees. Thereby, we offer new insights into the computational challenges of decision tree simplification, a crucial aspect of developing interpretable and efficient machine learning models. We focus on fundamental pruning operations of subtree replacement and raising, which are used in heuristics. Surprisingly, while optimal pruning can be performed in polynomial time for subtree replacement, the problem is NP-complete for subtree raising. Therefore, we identify parameters and combinations thereof that lead to fixed-parameter tractability or hardness, establishing a precise borderline between these complexity classes. For example, while subtree raising is hard for small domain size $D$ or number $d$ of features, it can be solved in $D^{2d} \cdot |I|^{O(1)}$ time, where $|I|$ is the input size. We complement our theoretical findings with preliminary experimental results, demonstrating the practical implications of our analysis.

On Computing Optimal Tree Ensembles

Random forests and, more generally, (decision\nobreakdash-)tree ensembles are widely used methods for classification and regression. Recent algorithmic advances allow to compute decision trees that are optimal for various measures such as their size or depth. We are not aware of such research for tree ensembles and aim to contribute to this area. Mainly, we provide two novel algorithms and corresponding lower bounds. First, we are able to carry over and substantially improve on tractability results for decision trees, obtaining a $(6\delta D S)^S \cdot poly$-time algorithm, where $S$ is the number of cuts in the tree ensemble, $D$ the largest domain size, and $\delta$ is the largest number of features in which two examples differ. To achieve this, we introduce the witness-tree technique which also seems promising for practice. Second, we show that dynamic programming, which has been successful for decision trees, may also be viable for tree ensembles, providing an $\ell^n \cdot poly$-time algorithm, where $\ell$ is the number of trees and $n$ the number of examples. Finally, we compare the number of cuts necessary to classify training data sets for decision trees and tree ensembles, showing that ensembles may need exponentially fewer cuts for increasing number of trees.