Deep learning for computational chemistry. Goh, G. B, Hodas, N. O, & Vishnu, A. Journal of Computational Chemistry, 38(16):1291–1307, 2017. Paper doi bibtex @article{goh_deep_2017,
title = {Deep learning for computational chemistry},
volume = {38},
issn = {1096-987X},
url = {http://dx.doi.org/10.1002/jcc.24764},
doi = {10.1002/jcc.24764},
number = {16},
journal = {Journal of Computational Chemistry},
author = {Goh, Garrett B and Hodas, Nathan O and Vishnu, Abhinav},
year = {2017},
keywords = {artificial intelligence, cheminformatics, deep learning, machine learning, materials genome, molecular modeling, protein structure prediction, quantitative structure activity relationship, quantum chemistry, toxicology},
pages = {1291--1307},
}
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