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Binding

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3 results in Keywords: Binding

Biological and Medicinal Chemistry

Insights into Generalization of the Rate-Limiting Steps of the Dehalogenation by LinB and DhaA: A Computational Approach

Agata Sowińska, Michał Rostkowski, Agnieszka Krzemińska, Tzofia Englman, Faina Gelman, Agnieszka Dybala-Defratyka

Version 2 posted 21 November 2022

264

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Theoretical and Computational Chemistry

Description of ion properties using molecular orbital energy levels

Sergey V. Doronin

Version 1 posted 22 July 2024

184

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Theoretical and Computational Chemistry

SE(3) Equivariant Topologies for Structure-based Drug Discovery

Alvaro Prat, Hisham Abdel Aty, Aurimas Pabrinkis, Orestis Bastas, Tanya Paquet, Gintautas Kamuntavičius, Roy Tal

Version 1 posted 18 October 2024

670

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