In silico strategies for discovering and analyzing new molecules based on isocycloseram: Virtual screening, docking, molecular dynamics, MM/PBSA, and GABA receptor interactions. - Taináh M. R. Santos; Artur G. Nogueira; Antônio P. L. Mesquita; Alexandre A. de Castro; Teodorico C. Ramalho (Comput. Biol. Chem., 2026)