<div dir="ltr">Hi Bu,<div><br></div><div style>If you don't mind hacking a bit, adding a third non-bonded argument to be used in the GPU kernel is rather simple. Additionally, adding user-provided tables should not be very hard either, we just did not have the time to make things general enough yet. I suggest that you should open a/two feature request(s) on the redmine page and we can discuss the technical details there, I willing to give you concrete suggestions on how to proceed. Moreover, it would be great if you would be willing to contribute code back to GROMACS, this way we could consider including the features required by you in the next official release!</div>
<div style><br></div><div style>Let us know if these sound like an option for you!</div><div style><br></div><div style>Cheers,</div></div><div class="gmail_extra"><br clear="all"><div>--<br>Szilárd</div>
<br><br><div class="gmail_quote">On Tue, Mar 19, 2013 at 11:02 AM, Bu <span dir="ltr"><<a href="mailto:bw2@alfred.edu" target="_blank">bw2@alfred.edu</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
Thank you, Berk. Unfortunately, two parameters are not enough. But now we<br>
know where to begin.<br>
<br>
Thanks,<br>
Bu<br>
<br>
<br>
<br>
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