Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00051B, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Brenden G. Pelkie, Stéphanie ValleauGaussian process regressors were successfuly…
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00083K, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Jenke Scheen, Mark Mackey, Julien MichelA data-driven approach for predicting ne…
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00073C, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Oliver Großmann, Daniel Bellaire, Nicolas Hayer, Fabian Jirasek, Hans HasseWe pr…
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00056C, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Benjamin A. Helfrecht, Giovanni Pireddu, Rocio Semino, Scott M. Auerbach, Michel…
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00046F, Communication Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Bojing Zhang, Leon Merker, Alexey Sanin, Helge S. SteinDemonstration of …
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00055E, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Yilin Yang, Mingjie Liu, John R. KitchinWith the popularity of machine learning …
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00038E, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Pablo Sánchez-Palencia, Said Hamad, Pablo Palacios, Ricardo Grau-Crespo, Keith T…
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00057A, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Chen Qu, Qi Yu, Riccardo Conte, Paul L. Houston, Apurba Nandi, Joe…
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D1DD00031D, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Prakriti Kayastha, Sabyasachi Chakraborty, Raghunathan Ramakrishna…
Digital Discovery, 2022, Advance ArticleDOI: 10.1039/D2DD00044J, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Paul Boone, Christopher E. WilmerMOFUN is an open-source Python package that can…