Results 331 to 340 of about 405,178 (360)

Descriptors representing two- and three-body atomic distributions and their effects on the accuracy of machine-learned inter-atomic potentials.

Journal of Chemical Physics, 2020
Ryosuke Jinnouchi, F. Karsai, C. Verdi, R. Asahi, G. Kresse   +4 more
semanticscholar   +1 more source

Learning general and distinctive 3D local deep descriptors for point cloud registration

IEEE Transactions on Pattern Analysis and Machine Intelligence, 2022
Fabio Poiesi, Davide Boscaini
exaly  

alvaDesc: A Tool to Calculate and Analyze Molecular Descriptors and Fingerprints

, 2020
A. Mauri
semanticscholar   +1 more source

Identifying descriptors for Li+ conduction in cubic Li-argyrodites via hierarchically encoding crystal structure and inferring causality

Energy Storage Materials, 2021
Bing He, Maxim Avdeev, Liquan Chen
exaly  

Designing Catalyst Descriptors for Machine Learning in Oxidative Coupling of Methane

ACS Catalysis, 2022
Sunao Nakanowatari, Lauren Takahashi, Toshiaki Taniike   +2 more
exaly  

Quantum chemical descriptors in quantitative structure–activity relationship models and their applications

, 2021
Liang-Liang Wang, Jun-Jie Ding, Li Pan, Dongsheng Cao, Hui Jiang, Xiao-Qin Ding   +5 more
semanticscholar   +1 more source

Reactivity Descriptors for the Activity of Molecular MN4 Catalysts for the Oxygen Reduction Reaction

Angewandte Chemie - International Edition, 2016
JOSÉ H Zagal, Marc T M Koper
exaly  

Determination of sets of solute descriptors from chromatographic measurements

Journal of Chromatography A, 2004
Michael H Abraham, Adam Ibrahim, Andreas M Zissimos   +2 more
exaly  

A widely applicable set of descriptors

Journal of Molecular Graphics and Modelling, 2000
Paul Labute
exaly  

Mask-CNN: Localizing parts and selecting descriptors for fine-grained bird species categorization

Pattern Recognition, 2018
Xiu-Shen Wei, Chen-Wei Xie, Jianxin Wu, Chunhua Shen   +3 more
semanticscholar   +1 more source