I am new user of ESPResSo. Unfortunately, I can only run the TCL
scripts, but pypresso causes errors that I cannot resolve on my own.
Is there a TCL counterpart of the python minimize_energy functionality?
If not may I ask for your help to resolve my problems with pypresso?
Thank you very much!
In the following, I summarize the error reports (full error reports are
included in the postscript).
I am using Xubuntu 16.04. Neither the latest release (3.3.1) of ESPResSo
nor cloning the python branch on GitHub worked. Resolving the problems
for any of the two would suffice.
(1) When I compiled the latest release (3.3.1), "import espressomd"
causes no problems, but "print(espressomd.features())" throws an error:
Traceback (most recent call last):
File "<stdin>", line 1, in <module>
AttributeError: 'module' object has no attribute 'features'
(2) Last week, I have cloned the python branch of ESPResSo and followed
the instructions for installation from the ESPResSo documentation.
"make install" was completed without errors.
However, "make check" reported a problem:
undefined reference to `boost::mpi::communicator::operator int() const'
When I import espressomd in "pypresso", the following error is reported:
libcluster_analysis.so.4: undefined symbol:
_ZNK5boost3mpi12communicatorcviEv