Protein–ligand data at scale to support machine learning

A.M. Edwards, Dafydd R. Owen, Leili Zhang, Damian W. Young, Timothy M. Willson, James Wellnitz, Yanli Wang, Jarrod Walsh, Erik Vernet, Alexander Tropsha, Claudia Tredup, Matthew H. Todd, Amelia Tjaden, Sven Thamm, M. Sundström, Andreas Steffen, Shaun R. Stauffer, Lucas R. de Souza, Min Shen, Kristof T. Schütt, Lovisa Holmberg Schiavone, Matthieu Schapira, Santha Santhakumar, Kumar Singh Saikatendu, Emma L. Rivers, Dušan Petrović, Hui Peng, John P. O’Donnell, Susanne Müller, Anke Mueller‐Fahrnow, Maxwell R. Morgan, Florian Montel, Juan Carlos Mobarec, Maurice Michel, Sofia Melliou, Uta Lessel, Andrew R. Leach, Oliver Krämer, Florian Krieger, S. Knapp, Anthony D. Keefe, Aimo Kannt, Scott A. Johnson, Sandra Häberle, Emily Holzinger, Ingo V. Hartung, Rachel Harding, Thomas Hanke, Levon Halabelian, Benjamin Haibe‐Kains, Judith Günther, Marie-Aude Guié, Cláudia R. Gordijo, O. Gileadi, Luca Foschini, Amaury E. Fernández‐Montalván, Ola Engkvist, Madison Edwards, Katharina Duerr, David H. Drewry, Dengfeng Dou, Snežana Djordjević, Alejandra Solache Diaz, Sergio Martínez Cuesta, Rafael M. Couñago, Wendy D. Cornell, Jesse A. Coker, Djork-Arné Clevert, Timothy A. Cernak, N. Burgess-Brown, Peter J. Brown, Mário Henrique Bengtson, Frances M. Bashore, Dalia Baršytė-Lovejoy, Arrash J. Baghaie, Alison D. Axtman, C.H. Arrowsmith, Albert A. Antolín, Suzanne Ackloo