GAUCHE: A Library for Gaussian Processes in ChemistryRyan-Rhys Griffiths,Leo Klarner,Henry Moss,Aditya Ravuri,Sang T. Truong,Yuanqi Du,Samuel Don Stanton,Gary Tom,Bojana Ranković,Arian Rokkum Jamasb,Aryan Deshwal, Julius Schwartz,Austin Tripp,Gregory Kell,Simon Frieder,Anthony Bourached,Alex James Chan,Jacob Moss,Chengzhi Guo,Johannes P. Dürholt, Saudamini Chaurasia,Ji Won Park,Felix Strieth-Kalthoff,Alpha Lee,Bingqing Cheng,Alan Aspuru-Guzik,Philippe Schwaller,Jian TangNeurIPS 2023（2023）引用 36|浏览87关键词Gaussian processes,Bayesian optimization,Chemistry,Molecular Machine Learning,Applications,SoftwareAI 理解论文溯源树样例生成溯源树，研究论文发展脉络Chat Paper正在生成论文摘要
