Unveiling the predictive power of static structure in glassy systems

Scikit-learn: Machine Learning in Python

Fabián Pedregosa, Gaël Varoquaux, Alexandre Gramfort et al. · arXiv (Cornell University) · 2012 · 63.7K citations · Full text

Computing, Computer Science, Artificial Intelligence +10

Fast Parallel Algorithms for Short-Range Molecular Dynamics

Steven J. Plimpton · Journal of Computational Physics · 1995 · 44.6K citations

Computing, High-performance Computing, Physics +10

Visualizing Data using t-SNE

Laurens van der Maaten, Geoffrey E. Hinton · Journal of Machine Learning Research · 2008 · 35.7K citations

Computing, Data Science, Visualization +13

Support-Vector Networks

Corinna Cortes, Vladimir Vapnik · Machine Learning · 1995 · 33K citations · Full text

The Graph Neural Network Model

Franco Scarselli, M. Gori, Ah Chung Tsoi et al. · IEEE Transactions on Neural Networks · 2008 · 9.3K citations · Full text

Computing, Computer Science, Molecular Biology +13