Search found 7 matches

by Jack Wieting
Fri Oct 01, 2010 11:15 am
Forum: OpenMM
Topic: building openmm on linux from src
Replies: 4
Views: 641

RE: building openmm on linux from src

<t>Hey Peter,<br/> <br/> Thanks for taking the time to help me. I think I figured out what is wrong although it is very strange.<br/> <br/> I think that "hidden" characters may have caused these issues because if I delete a line that is causing issues and then retype it that issue goes away-as if I ...
by Jack Wieting
Thu Sep 30, 2010 12:29 pm
Forum: OpenMM
Topic: building openmm on linux from src
Replies: 4
Views: 641

RE: building openmm on linux from src

cmake 2.8.2 which should be good enough since the suggested version is 2.6 or higher.
by Jack Wieting
Thu Sep 30, 2010 11:34 am
Forum: OpenMM
Topic: building openmm on linux from src
Replies: 4
Views: 641

building openmm on linux from src

<t>Hi,<br/> <br/> I having a problem building openmm on a linux machine from source. I was able to do it on the mac (after having some troubles early on), and then was able to make changes to the source code to fit my application. Now I want to use this changed source code on a linux machine because...
by Jack Wieting
Fri Aug 20, 2010 3:04 pm
Forum: OpenMM
Topic: make install-missing file?
Replies: 3
Views: 470

RE: make install-missing file?

<t>Here is some more information. To compile cuda programs I need to type:<br/> <br/> nvcc --include-path /usr/local/cuda/include -L/usr/local/cuda/lib -lcuda -lcudart -lm -lpthread<br/> <br/> before the source fils. If I type:<br/> <br/> nvcc --include-path /usr/local/cuda/include<br/> <br/> I get ...
by Jack Wieting
Thu Aug 19, 2010 5:29 pm
Forum: OpenMM
Topic: make install-missing file?
Replies: 3
Views: 470

RE: make install-missing file?

<t>Thanks for the response Peter, but the errors are still there. I have included some more of the error below. Any more ideas would be greatly appreciated.<br/> <br/> Linking CXX shared library libOpenMM.dylib<br/> Undefined symbols:<br/> "_cudaEventSynchronize", referenced from:<br/> kApplyCCMA(_g...
by Jack Wieting
Thu Aug 19, 2010 10:51 am
Forum: OpenMM
Topic: make install-missing file?
Replies: 3
Views: 470

make install-missing file?

<t>I am having a little issue trying to build openmm from source. I got so far as to run make test and all the tests passed, but then when I do make install errors pop up when it tries to link the shared library libOpenMM.dylib. I think some file is missing but I am not sure, all the errors are cuda...
by Jack Wieting
Mon Jul 19, 2010 12:43 pm
Forum: OpenMM
Topic: Exclusions for protein docking
Replies: 3
Views: 539

Exclusions for protein docking

<t>Hi, I am trying to use openMM to perform protein docking calculations. Is there a way in openMM to just calculate the potential energies between the atoms of different interacting partners (i.e. molecules) of a system, excluding the energetic contributions that arise from the internal interaction...