Solvation Search

Use this form to find solvation properties of a solute and solvent combination. Choose a solute molecule by entering its species or adjacency list. Select the solvent molecule you would like to be included in your solvation estimation in the drop down menu.

You can browse the available solute molecules here: Solute Molecules

You can browse the available solvent molecules here: Solvent Molecules

Any solute can be used in this search form. The search will pull the solute data if it exists in the library, otherwise it will estimate the solvation properties using the Abraham parameters to perform group estimation.