<!DOCTYPE HTML PUBLIC "-//W3C//DTD HTML 4.0 Transitional//EN">
<HTML><HEAD>
<META content="text/html; charset=gb2312" http-equiv=Content-Type>
<META name=GENERATOR content="MSHTML 8.00.6001.19154">
<STYLE>@font-face {
        font-family: ËÎÌå;
}
@font-face {
        font-family: Verdana;
}
@font-face {
        font-family: @ËÎÌå;
}
@page Section1 {size: 595.3pt 841.9pt; margin: 72.0pt 90.0pt 72.0pt 90.0pt; layout-grid: 15.6pt; }
P.MsoNormal {
        TEXT-JUSTIFY: inter-ideograph; TEXT-ALIGN: justify; MARGIN: 0cm 0cm 0pt; FONT-FAMILY: "Times New Roman"; FONT-SIZE: 10.5pt
}
LI.MsoNormal {
        TEXT-JUSTIFY: inter-ideograph; TEXT-ALIGN: justify; MARGIN: 0cm 0cm 0pt; FONT-FAMILY: "Times New Roman"; FONT-SIZE: 10.5pt
}
DIV.MsoNormal {
        TEXT-JUSTIFY: inter-ideograph; TEXT-ALIGN: justify; MARGIN: 0cm 0cm 0pt; FONT-FAMILY: "Times New Roman"; FONT-SIZE: 10.5pt
}
A:link {
        COLOR: blue; TEXT-DECORATION: underline
}
SPAN.MsoHyperlink {
        COLOR: blue; TEXT-DECORATION: underline
}
A:visited {
        COLOR: purple; TEXT-DECORATION: underline
}
SPAN.MsoHyperlinkFollowed {
        COLOR: purple; TEXT-DECORATION: underline
}
SPAN.EmailStyle17 {
        FONT-STYLE: normal; FONT-FAMILY: Verdana; COLOR: windowtext; FONT-WEIGHT: normal; TEXT-DECORATION: none; mso-style-type: personal-compose
}
DIV.Section1 {
        page: Section1
}
UNKNOWN {
        FONT-SIZE: 10pt
}
BLOCKQUOTE {
        MARGIN-TOP: 0px; MARGIN-BOTTOM: 0px; MARGIN-LEFT: 2em
}
OL {
        MARGIN-TOP: 0px; MARGIN-BOTTOM: 0px
}
UL {
        MARGIN-TOP: 0px; MARGIN-BOTTOM: 0px
}
</STYLE>
</HEAD>
<BODY style="MARGIN: 10px; FONT-FAMILY: verdana; FONT-SIZE: 10pt">
<DIV><FONT size=2>try </FONT></DIV>
<DIV><FONT size=2>nvidia-smi -a</FONT></DIV>
<DIV>to see whether the GPU card has been correctly configured. </DIV>
<DIV>This happens on my GPU node. Every time I reboot the computer,&nbsp;I must 
reconfigure the GPU cards with "nvidia-smi -a" using root account.</DIV>
<DIV><FONT size=2></FONT>&nbsp;</DIV>
<DIV><FONT size=2></FONT>Ye</DIV>
<DIV>2011-11-17 </DIV>
<DIV>
<HR color=#b5c4df SIZE=1>
</DIV>
<DIV><FONT size=2><STRONG>From£º</STRONG> Andrzej Rzepiela </FONT></DIV>
<DIV><FONT size=2><STRONG>Date£º</STRONG> 2011-11-17&nbsp; 21:01:07 </FONT></DIV>
<DIV><FONT size=2><STRONG>To£º</STRONG> gmx-users </FONT></DIV>
<DIV><FONT size=2><STRONG>CC£º</STRONG> </FONT></DIV>
<DIV><FONT size=2><STRONG>Subject£º</STRONG> [gmx-users] Cuda not detected 
</FONT></DIV>
<DIV><FONT size=2></FONT> </DIV>
<DIV><FONT size=2>
<DIV>Hey,</DIV>
<DIV></DIV>
<DIV>I&nbsp;am&nbsp;playing&nbsp;with&nbsp;the&nbsp;gpu&nbsp;version&nbsp;of&nbsp;mdrun&nbsp;and&nbsp;could&nbsp;make&nbsp;it&nbsp;run&nbsp;with:</DIV>
<DIV></DIV>
<DIV>~/gromacs/gpu/bin/mdrun-gpu&nbsp;-s&nbsp;topol.tpr&nbsp;-device&nbsp;&nbsp;</DIV>
<DIV>"OpenMM:platform=Cuda,memtest=15,deviceid=0,force-device=yes"</DIV>
<DIV></DIV>
<DIV>However&nbsp;after&nbsp;reboot&nbsp;of&nbsp;the&nbsp;machine&nbsp;(&nbsp;which&nbsp;is&nbsp;a&nbsp;testing&nbsp;machine)</DIV>
<DIV></DIV>
<DIV>I&nbsp;get&nbsp;the&nbsp;following&nbsp;error:</DIV>
<DIV></DIV>
<DIV></DIV>
<DIV>-------------------------------------------------------</DIV>
<DIV>Program&nbsp;mdrun-gpu,&nbsp;VERSION&nbsp;4.5.5</DIV>
<DIV>Source&nbsp;code&nbsp;file:&nbsp;/home/weber/gromacs/gromacs-4.5.5_gpu/src/kernel/&nbsp;</DIV>
<DIV>openmm_wrapper.cpp,&nbsp;line:&nbsp;1272</DIV>
<DIV></DIV>
<DIV>Fatal&nbsp;error:</DIV>
<DIV>The&nbsp;requested&nbsp;platform&nbsp;"Cuda"&nbsp;could&nbsp;not&nbsp;be&nbsp;found.</DIV>
<DIV></DIV>
<DIV></DIV>
<DIV>echo&nbsp;$LD_LIBRARY_PATH:/opt/software/ganglia-3.1.7/lib64:/opt/software/&nbsp;</DIV>
<DIV>htop-0.8.3:/usr/local/cuda/lib64:/usr/local/cuda/lib:/home/weber/&nbsp;</DIV>
<DIV>OpenMM3.1.1-Linux64/lib</DIV>
<DIV></DIV>
<DIV>echo&nbsp;$PATH/usr/local/bin:/usr/bin:/bin:/usr/X11R6/bin:/usr/games:/usr/&nbsp;</DIV>
<DIV>lib64/jvm/jre/bin:/opt/software/nvidia/3.2.16/cuda/bin:/opt/software/&nbsp;</DIV>
<DIV>ganglia-3.1.7/bin:/opt/software/htop-0.8.3/bin:/usr/lib/mit/bin:/usr/&nbsp;</DIV>
<DIV>lib/mit/sbin:.:/usr/local/cuda/bin:/home/weber/cmake-2.8.6/bin</DIV>
<DIV></DIV>
<DIV></DIV>
<DIV>I&nbsp;run&nbsp;a&nbsp;simple&nbsp;gpu&nbsp;test&nbsp;program&nbsp;and&nbsp;it&nbsp;&nbsp;works.</DIV>
<DIV></DIV>
<DIV>I&nbsp;believe&nbsp;something&nbsp;is&nbsp;not&nbsp;linked&nbsp;correctly,&nbsp;maybe&nbsp;someone&nbsp;can&nbsp;give&nbsp;me&nbsp;&nbsp;</DIV>
<DIV>a&nbsp;hint.</DIV>
<DIV></DIV>
<DIV>Thank&nbsp;You</DIV>
<DIV></DIV>
<DIV>Andrzej</DIV>
<DIV></DIV>
<DIV>--&nbsp;</DIV>
<DIV>gmx-users&nbsp;mailing&nbsp;list&nbsp;&nbsp;&nbsp;&nbsp;gmx-users@gromacs.org</DIV>
<DIV>http://lists.gromacs.org/mailman/listinfo/gmx-users</DIV>
<DIV>Please&nbsp;search&nbsp;the&nbsp;archive&nbsp;at&nbsp;http://www.gromacs.org/Support/Mailing_Lists/Search&nbsp;before&nbsp;posting!</DIV>
<DIV>Please&nbsp;don't&nbsp;post&nbsp;(un)subscribe&nbsp;requests&nbsp;to&nbsp;the&nbsp;list.&nbsp;Use&nbsp;the&nbsp;</DIV>
<DIV>www&nbsp;interface&nbsp;or&nbsp;send&nbsp;it&nbsp;to&nbsp;gmx-users-request@gromacs.org.</DIV>
<DIV>Can't&nbsp;post?&nbsp;Read&nbsp;http://www.gromacs.org/Support/Mailing_Lists</DIV></FONT></DIV></BODY></HTML>