Author:
Zhang Lifeng,Karia Tanuj,Chaparro Gustavo,Sahebzada Kainath,Chachuat Benoît,Adjiman Claire S.
Funder
Engineering and Physical Sciences Research Council
Reference13 articles.
1. Optuna: A Next-generation Hyperparameter Optimization Framework, in: Proceedings of the 25th ACM SIGKDD International Conference on nowledge Discovery & Data Mining, DD ' 9 Association for Computing Machinery;Akiba,2019
2. Gibbs Energy Analysis of Phase Equilibria;Baker;Society of Petroleum Engineers Journal,1982
3. Phasepy: A Python based framework for fluid phase equilibria and interfacial properties computation;Chaparro;Journal of Computational Chemistry,2020
4. The advantages of the Matthews correlation coefficient (MCC) over F1 score and accuracy in binary classification evaluation;Chicco;BMC Genomics,2020
5. Support-vector networks;Cortes;Mach Learn,1995