[gmx-users] generating a box containing NaOH + water

Anirban Mudi anirban.mudi at gmail.com
Fri Dec 28 19:53:59 CET 2007

Hi Subhrangshu

Please try packmol


You just need the coordinates of a single molecule of NaOH, water and the
solute to generate the whole system.

let me know if it works for you.


Be the change you wish to see

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