@misc{takehiro2022a, title = {Understanding the evolution of a de novo molecule generator via characteristic functional group monitoring}, author = {Takehiro Fujita, Kei Terayama, Masato Sumita, Ryo Tamura, Yasuyuki Nakamura, Masanobu Naito, Koji Tsuda}, publisher = {}, year = {2022-12-31}, keywords = {characteristic functional group monitoring, chromophore, De novo molecule generation, deep learning} }