@article{proteinstructurefunctionrelationshipa, title = {Protein Structure-Function Relationship: A Kernel-PCA Approach for Reaction Coordinate Identification}, author = {Parisa Mollaei and Amir Barati Farimani}, year = {2025}, eprint = {2503.19186}, archivePrefix = {arXiv}, url = {https://arxiv.org/abs/2503.19186v1}, }