by Konstantin Gubaev, Evgeny V. Podryabinkin, Alexander V. Shapeev
Reference:
Machine learning of molecular properties: Locality and active learning (Konstantin Gubaev, Evgeny V. Podryabinkin, Alexander V. Shapeev), The Journal of Chemical Physics, AIP Publishing, volume 148, 2018.
Bibtex Entry:
@article{Gubaev2018,
doi = {10.1063/1.5005095},
url = {https://doi.org/10.1063/1.5005095},
year = {2018},
month = {jun},
publisher = {{AIP} Publishing},
volume = {148},
number = {24},
pages = {241727},
author = {Konstantin Gubaev and Evgeny V. Podryabinkin and Alexander V. Shapeev},
title = {Machine learning of molecular properties: Locality and active learning},
journal = {The Journal of Chemical Physics},
url = {http://www.shapeev.com/my_papers/Gubaev2018-chem.pdf},
eprint = {1709.07082},
cat = {IP}
}