A generalized deep learning approach for local structure identification in molecular simulations
Keyword(s):
We demonstrate a PointNet-based deep learning approach to classify local structure in molecular simulations, learning features directly from atomic coordinates.
2018 ◽
Vol 6
(3)
◽
pp. 122-126
2018 ◽
Vol 15
(1)
◽
pp. 6-28
◽
2020 ◽
Vol 13
(4)
◽
pp. 1972-1980
2017 ◽
Vol V
(III)
◽
pp. 5-10