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2001.05972
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Topological Descriptors Help Predict Guest Adsorption in Nanoporous Materials
16 January 2020
Aditi S. Krishnapriyan
Maciej Haranczyk
Dmitriy Morozov
OOD
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Papers citing
"Topological Descriptors Help Predict Guest Adsorption in Nanoporous Materials"
3 / 3 papers shown
Title
MOFFlow: Flow Matching for Structure Prediction of Metal-Organic Frameworks
N. Kim
Seongsu Kim
Minsu Kim
Jinkyoo Park
Sungsoo Ahn
AI4CE
48
1
0
07 Oct 2024
Prediction of
CO
2
\textrm{CO}_2
CO
2
Adsorption in Nano-Pores with Graph Neural Networks
Guojing Cong
Anshul Gupta
R. Neumann
Maira Gatti de Bayser
Mathias Steiner
B. O. Conchúir
GNN
39
1
0
22 Aug 2022
Topology-Driven Generative Completion of Lacunae in Molecular Data
Dmitry Zubarev
Petar Ristoski
30
0
0
29 Jul 2022
1