@misc{indiciae177901aec4b2, title = {Mechanistic Dissection of Entropic Penalty upon Ligand Binding and Molecular Flexibility via Molecular Dynamics Simulations and Machine Learning}, author = {Hung, T. I. and Vig, E. and Chang, C.-e.}, year = {2026}, doi = {10.64898/2026.08.18.745526}, url = {https://www.biorxiv.org/content/10.64898/2026.08.18.745526v1}, note = {Source identifier: 10.64898/2026.08.18.745526} }