AbstractIn this talk, I will introduce some work of learning constitutive equations in fluid mechanics and geophysics based on machine learningSpeaker Intro熊繁升,现任北京雁栖湖应用数学研究院助理研究员,曾任北京应用物理与计算数学研究所所聘博士后。先后毕业于中国地质大学(北京)、清华大学,美国耶鲁大学联合培养博士。研究兴趣主要集中于基于机器学习算法(DNN、PINN、DeepONet等)求解微分方程模型正/反问题...
AbstractArtificial intelligence (AI) based drug design has demonstrated great potential to fundamentally change the pharmaceutical industries. However, a key issue in all AI-based drug design models is efficient molecular representation and featurization. Recently, topological data analysis (TDA) has been used for molecular representations and its combination with machine learning models have a...