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Biological and Medicinal Chemistry

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Theoretical and Computational Chemistry

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Working Paper

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artifical intelligence

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2 results in Keywords: artifical intelligence

Theoretical and Computational Chemistry

Model agnostic generation of counterfactual explanations for molecules

Geemi P Wellawatte, Aditi Seshadri, Andrew D White

Version 2 posted 06 September 2021

2,499

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1

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Biological and Medicinal Chemistry

A machine learning platform to estimate anti-SARS-CoV-2 activities

Govinda KC, Giovanni Bocci, Srijan Verma, Mahmudulla Hassan, Jayme Holmes, Jeremy Yang, suman sirimulla, Tudor I. Oprea

Version 3 posted 19 March 2021

1,380

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