<a href="http://www.gromacs.org/Documentation/How-tos/Constant_pH_Simulation" target="_blank">http://www.gromacs.org/Documentation/How-tos/Constant_pH_Simulation</a><br><br><div class="gmail_quote">On 7 September 2011 11:01, Emanuel Peter <span dir="ltr"><<a href="mailto:Emanuel.Peter@chemie.uni-regensburg.de">Emanuel.Peter@chemie.uni-regensburg.de</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex;"><div style="font-family:Tahoma, sans-serif;font-size:13px">At first I would like to say that I deeply apologize for <br>
the cave-like things I have said. I again say, that this<br>was not the field I am deeply involved.<br>From Gerrit I got a banana.<br>For this guy, I am a cave-man.<br><br>Thanks, for being such ready for open discussion. <br>
<br>I did not tell that I do not want to be wrong.<br>Questions, which are included in my doubts: <br><br>Generalized forces and averages for H+ interchange ?<br>Comparison with titration experiments ?<br>Is there any experimental evidence for the rates of<br>
interchange ?<br>Are simulation-times or the periods of interchange at <br>any time realistic?<br>Are equilibria sampled well, with such interchanges,<br>or are there jumps in free energy by this interchange ?<br>Why is there no free H+ ?<br>
<br>Thanks for your kind and very constructive criticisms.<br><br>I would appreciate, if this so-called discussion will <br>find an end.<br>I am deeply depressed about such comments and<br>I will not take part in any users-discussion in the future.<br>
It makes no sense, because talking like this expresses<br>the way on how science is done today. Repelling that<br>person, who does not walk the common way.<br>And:<br><br>Maybe I have lived in a cave, but someone like you, who answers in <br>
such a way, IS A CAVEMAN !<br><br>>>> Joćo Henriques<<a href="mailto:joao.henriques.32353@gmail.com" target="_blank">joao.henriques.32353@gmail.com</a>> 07.09.11 11.30 Uhr >>><div><div></div><div class="h5">
<br>There is no problem in being wrong. The problem is that he wants to be<br>wrong. At least 4 different researchers gave constructive input and<br>this subject keeps hitting the same key. I've always been told that<br>
worse than not knowing, is not wanting to know.<br><br>Still, I apologize for my outburst.<br><br>Best regards,<br><br>On Wed, Sep 7, 2011 at 1:54 AM, Mark Abraham <<a href="mailto:Mark.Abraham@anu.edu.au" target="_blank">Mark.Abraham@anu.edu.au</a>> wrote:<br>
> On 7/09/2011 3:53 AM, Joćo Henriques wrote:<br>>><br>>> I guess someone has been living in a cave for the past decade or so...<br>><br>> Please keep contributions to the mailing list constructive :-) Everyone's<br>
> been wrong before!<br>><br>> Mark<br>> --<br>> gmx-users mailing list <a href="mailto:gmx-users@gromacs.org" target="_blank">gmx-users@gromacs.org</a><br>> <a href="http://lists.gromacs.org/mailman/listinfo/gmx-users" target="_blank">http://lists.gromacs.org/mailman/listinfo/gmx-users</a><br>
> Please search the archive at<br>> <a href="http://www.gromacs.org/Support/Mailing_Lists/Search" target="_blank">http://www.gromacs.org/Support/Mailing_Lists/Search</a> before posting!<br>> Please don't post (un)subscribe requests to the list. Use the www interface<br>
> or send it to <a href="mailto:gmx-users-request@gromacs.org" target="_blank">gmx-users-request@gromacs.org</a>.<br>> Can't post? Read <a href="http://www.gromacs.org/Support/Mailing_Lists" target="_blank">http://www.gromacs.org/Support/Mailing_Lists</a><br>
><br><br><br><br>-- <br>Joćo Henriques<br>--<br>gmx-users mailing list <a href="mailto:gmx-users@gromacs.org" target="_blank">gmx-users@gromacs.org</a><br><a href="http://lists.gromacs.org/mailman/listinfo/gmx-users" target="_blank">http://lists.gromacs.org/mailman/listinfo/gmx-users</a><br>
Please search the archive at <a href="http://www.gromacs.org/Support/Mailing_Lists/Search" target="_blank">http://www.gromacs.org/Support/Mailing_Lists/Search</a> before posting!<br>Please don't post (un)subscribe requests to the list. Use the<br>
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<br>--<br>
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Please search the archive at <a href="http://www.gromacs.org/Support/Mailing_Lists/Search" target="_blank">http://www.gromacs.org/Support/Mailing_Lists/Search</a> before posting!<br>
Please don't post (un)subscribe requests to the list. Use the<br>
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Can't post? Read <a href="http://www.gromacs.org/Support/Mailing_Lists" target="_blank">http://www.gromacs.org/Support/Mailing_Lists</a><br></blockquote></div><br><br clear="all"><br>-- <br><font color="#888888"></font>Diogo Vila Viēosa, MSc in Biochemistry<br>
Faculty of Science of the University
of Lisbon<br>Department of Chemistry and Biochemistry<br>C8 Building,
Room 8.5.47<br>Campo Grande, 1749-016 Lisbon, Portugal<br>
E-mail: <a href="mailto:diogo.vicosa@fc.ul.pt" target="_blank">diogo.vicosa@fc.ul.pt</a><br><font color="#888888"><div><a href="http://intheochem.fc.ul.pt/members/diogovv.html" target="_blank">http://intheochem.fc.ul.pt/members/diogovv.html</a></div>
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