George E. Dahl, Navdeep Jaitly, Ruslan Salakhutdinov
TL;DR本文使用神经网络预测复合物在多个实验中的活性,并发现神经网络方法优于其他方法。
Abstract
Although artificial neural networks have occasionally been used for
quantitative structure-activity/property relationship (QSAR/QSPR) studies in
the past, the literature has of late been dominated by other machin