Kuzminykh D.; Polykovskiy D.; Kadurin A.; Zhebrak A.; Baskov I.; Nikolenko S.; Shayakhmetov R.; Zhavoronkov A.
(2018)
© 2018 American Chemical Society. Convolutional neural networks (CNN) have been successfully used to handle three-dimensional data and are a natural match for data with spatial structure such as 3D molecular structures. ...