Author

A. A. A. M. M. Alkhatip

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Open access Sep 2026

Structure-based molecular modeling of a novel S-Remiketamine scaffold and derived arylcyclohexanone analogues: NMDA receptor dynamics, MM-GBSA ranking, and CES1-Oriented structural compatibility

These results support R2 as the strongest static NMDA docking/NMDA-preference benchmark and R14 as the most internally consistent integrated computational candidate and the most internally consistent integrated computational candidate.

A. A. A. M. M. Alkhatip, U. Raza, Ehab Farag et al. · Frontiers in Chemistry · 0 citations

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