Hydration structure and energetic signatures of hemidirected- and holodirected-like Motifs in aqueous Pb 2 + : A SCAN–QMCF–MD and DLPNO–CCSD(T) study

Journal of Molecular Graphics and Modelling 2026

View at publisher

Authors: Niko Prasetyo, Karna Wijaya, Rahadian Zainul, Anugrah Ricky Wijaya, Nur Abdillah Siddiq

DOI: 10.1016/j.jmgm.2026.109353

Cited by: 1

References: 39

Fields of Study & Subjects

Spectroscopy and Quantum Chemical Studies Molecular Sensors and Ion Detection Crystallography and molecular interactions

References 39