Interpretable machine learning rationalizes carbonic anhydrase inhibition via conformal and counterfactual prediction
M
Masoumeh Shams Ghamsary
M
Milad Rayka
S
S. Shahab Naghavi
(Department of Physical and Computational Chemistry)
Article Details
Journal
Scientific Reports
Volume / Issue
Vol. 16, Issue 1
Published
February 11, 2026
ISSN
2045-2322
Publisher
Nature Portfolio
Authors (3)
M
Masoumeh Shams Ghamsary
M
Milad Rayka
S
S. Shahab Naghavi
Department of Physical and Computational Chemistry
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