I completed my Master's degree in Chemical Engineering from National Taiwan University, Taiwan. I am immersed in learning modern web development techniques, and now I am a frontend engineer.
chaoting-sun / ga-vs-transformer Goto Github PK
View Code? Open in Web Editor NEWOptimize molecules with trained Transformers and Genetic Algorithms, focusing on logP while considering various chemical properties. Evaluate exploration effectiveness through validity, uniqueness, novelty, and internal diversity metrics.