Molecular topologies of molecules present in the vacuum/SDS/water system using different charge distribution types
收藏Mendeley Data2026-04-09 收录
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资源简介：
This data contained the bonded and non-bonded of the molecules used in MD simulations. Charge distributions used in the determination of the electrostatic contribution are shown in these topologies.
提供机构：
Universidad de Carabobo; Escuela Superior Politecnica del Litoral; Pontificia Universidad Catolica de Chile; Universidad Nacional Autonoma de Mexico Instituto de Investigaciones en Materiales; Universidad Autonoma de Chile
