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<p>Hi, all!</p>
<p><br></p>
<p>Is are any who uses GMX in MPI mode under cygwin?</p>
<p><br></p>
<p>I'm trying to install it. Based on oldgromacs site and wiki I installed cygwin, FFTW and LAM/MPI. Unfortunately I failed to install libaio and leaved it out. But when configuring gromacs with</p>
<p><br></p>
<p>./configure --enable-mpi --disable-float --enable-sse2 --enable-shared LDFLAGS='-L/usr/local/lib'</p>
<p><br></p>
<p>it returns </p>
<p><br></p>
<p>checking for mpicc... mpicc</p>
<p>checking whether the MPI cc command works... configure: error: Cannot compile and link MPI code with mpicc</p>
<p><br></p>
<p>Alternatively I try "Quick and Dirty Installation" from wiki with openmpi, where all is OK until Gromacs configuring with</p>
<p><br></p>
<p>./configure --prefix=$SOFT --enable-mpi --with-gsl</p>
<p><br></p>
<p>The end of return is</p>
<p><br></p>
<p>checking for mpxlc... no</p>
<p>checking for mpicc... no</p>
<p>checking for mpcc... no</p>
<p>checking for hcc... no</p>
<p>checking whether the MPI cc command works... configure: error: Cannot compile and link MPI code with cc</p>
<p><br></p>
<p>Thanks in advance!</p>
<p><span class=rvts6><br></span></p>
<p><span class=rvts6>-- </span></p>
<p>Regards<span class=rvts6>,</span></p>
<p><span class=rvts6> Dmitri </span><a class=rvts7 href="mailto:ddubov@ngs.ru">mailto:ddubov@ngs.ru</a></p>
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