Crystallographic characterization of the high-potential iron-sulfur protein in the oxidized state at 0.8 Å resolution
Hiraku Ohno, Kazuki Takeda, Satomi Niwa, Tomotaka Tsujinaka, Yuya Hanazono, Yu Hirano, and Kunio Miki · 1932
Earlier work this paper cites.
Computer "Experiments" on classical fluids. I. thermodynamical properties of Lennard-Jones molecules
Loup Verlet · 1967
Earlier work this paper cites.
Bond-orientational order in liquids and glasses
Paul J. Steinhardt, David R. Nelson, and Marco Ronchetti · 1983
Earlier work this paper cites.
Back propagation in a Clifford algebra
Justin Pearson and David Bisset · 1992
Earlier work this paper cites.
Neural networks in the Clifford domain
J.K. Pearson and D.L. Bisset · 1994
Earlier work this paper cites.
A new self-organizing neural network using geometric algebra
E. Bayro-Corrochano, S. Buchholz, and G. Sommer · 1996
Earlier work this paper cites.
The Protein Data Bank
Helen M. Berman, John Westbrook, Zukang Feng, Gary Gilliland, T. N. Bhat, Helge Weissig, Ilya N. Shindyalov, and Philip E. Bourne · 2000
Earlier work this paper cites.
Time reversible and symplectic integrators for molecular dynamics simulations of rigid molecules
H. Kamberaj, R. J. Low, and M. P. Neal · 2005
Earlier work this paper cites.
On Clifford neurons and Clifford multi-layer perceptrons
Sven Buchholz and Gerald Sommer · 2008
Earlier work this paper cites.
Perspective on the Martini model
Siewert J. Marrink and D. Peter Tieleman · 2013
Earlier work this paper cites.
Shortcomings of the bond orientational order parameters for the analysis of disordered particulate matter
Walter Mickel, Sebastian C. Kapfer, Gerd E. Schröder-Turk, and Klaus Mecke · 2013
Earlier work this paper cites.
Adam: A method for stochastic optimization
Diederik P. Kingma and Jimmy Ba · 2015
Earlier work this paper cites.
"Newton’s cradle" proton relay with amide–imidic acid tautomerization in inverting cellulase visualized by neutron crystallography
Akihiko Nakamura, Takuya Ishida, Katsuhiro Kusaka, Taro Yamada, Shinya Fushinobu, Ichiro Tanaka, Satoshi Kaneko, Kazunori Ohta, Hiroaki Tanaka, Koji Inaka, Yoshiki Higuchi, Nobuo Niimura, Masahiro Samejima, and Kiyohiko Igarashi · 2015
Earlier work this paper cites.
High-resolution crystal structures of the solubilized domain of porcine cytochrome b5
Y. Hirano, S. Kimura, and T. Tamada · 2015
Earlier work this paper cites.
Water-mediated recognition of simple alkyl chains by heart-type fatty-acid-binding protein
Shigeru Matsuoka, Shigeru Sugiyama, Daisuke Matsuoka, Mika Hirose, Sébastien Lethu, Hikaru Ano, Toshiaki Hara, Osamu Ichihara, S. Roy Kimura, Satoshi Murakami, Hanako Ishida, Eiichi Mizohata, Tsuyoshi Inoue, and Michio Murata · 2015
Earlier work this paper cites.
ADP-ribose pyrophosphatase reaction in crystalline state conducted by consecutive binding of two manganese(ii) ions as cofactors
Yoshihiko Furuike, Yuka Akita, Ikuko Miyahara, and Nobuo Kamiya · 2016
Earlier work this paper cites.
Machine learning of accurate energy-conserving molecular force fields
Stefan Chmiela, Alexandre Tkatchenko, Huziel E. Sauceda, Igor Poltavsky, Kristof T. Schütt, and Klaus-Robert Müller · 2017
Earlier work this paper cites.
PointNet: Deep learning on point sets for 3D classification and segmentation
Charles R. Qi, Hao Su, Mo Kaichun, and Leonidas J. Guibas · 2017
Earlier work this paper cites.
Deep sets
Manzil Zaheer, Satwik Kottur, Siamak Ravanbakhsh, Barnabas Poczos, Russ R. Salakhutdinov, and Alexander J. Smola · 2017
Earlier work this paper cites.
SchNet: A continuous-filter convolutional neural network for modeling quantum interactions
K. T. Schütt, P.-J. Kindermans, H. E. Sauceda, S. Chmiela, A. Tkatchenko, and K.-R. Müller · 2017
Earlier work this paper cites.
Attention is all you need
Ashish Vaswani, Noam Shazeer, Niki Parmar, Jakob Uszkoreit, Llion Jones, Aidan N Gomez, Łukasz Kaiser, and Illia Polosukhin · 2017
Earlier work this paper cites.
The AFLOW library of crystallographic prototypes: Part 1
Michael J. Mehl, David Hicks, Cormac Toher, Ohad Levy, Robert M. Hanson, Gus Hart, and Stefano Curtarolo · 2017
Earlier work this paper cites.