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Mohamed Elanany
Publication Activity (10 Years)
Years Active: 2022-2022
Publications (10 Years): 1
Top Topics
Fully Automated
Theoretical Framework
State Transition
Intelligent Search
Top Venues
SoftwareX
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Publications
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Sibo Lin
,
Mohamed Elanany
,
Motaz Khawaji
XTBDFT: Automated workflow for conformer searching of minima and transition states powered by extended tight binding and density functional theory.
SoftwareX
20 (2022)