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rotamers

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2 results in Keywords: rotamers

Biological and Medicinal Chemistry

Seeing double: the persistent dimer-of-dimers structure of drug resistant influenza A M2

Marianna Stampolaki, Abel Varkey, Evgeny Nimerovsky, Andrei Leonov, Stefan Becker, loren andreas

Version 1 posted 29 May 2024

74

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Physical Chemistry

Transferable Neural Network Potential Energy Surfaces for Closed-Shell Organic Molecules: Extension to Ions

Leif Jacobson, James Stevenson, Farhad Ramezanghorbani, Delaram Ghoreishi, Karl Leswing, Ed Harder, Robert Abel

Version 3 posted 21 February 2022

1,794

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