<div dir="ltr">Hi all,<div>Â Â I encounter a problem for the QM/MM simulation when using TIP4P water model. I use the AMBER top and rst file in CP2K. As you know, there is a auxiliary point in TIP4P water model. In amber, it is called "EP". But it can not be specified in CP2K when it is included in QM. Then how can I deal with this situation?</div><div>Â Â Best regards,</div><div>Â Â Â Zhi</div></div>