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0.0 2.0 0.0 68.87 MB

Main ESPResSo++ repository

Home Page: http://www.espresso-pp.de/

License: GNU General Public License v3.0

CMake 0.15% Tcl 0.02% Python 8.33% C++ 85.58% Perl 0.01% C 1.24% Shell 0.01% Batchfile 0.03% Fortran 0.02% HTML 4.14% CSS 0.10% JavaScript 0.19% Roff 0.18% TeX 0.01% Dockerfile 0.01% SWIG 0.01%

espressopp's Introduction

ESPResSo++

ESPResSo++ is an extensible, flexible, fast and parallel simulation software for soft matter research. It is a highly versatile software package for the scientific simulation and analysis of coarse-grained atomistic or bead-spring models as they are used in soft matter research. ESPResSo and ESPResSo++ have common roots and share parts of the developer/user community. However their development is independent and they are different software packages. ESPResSo++ is free, open-source software published under the GNU General Public License (GPL).

QUICKSTART:

To get a copy of the developer version (most recent version) of ESPResSo++, you can use git or docker. Using docker will give you a binary release (nothing to compile, but performance may not be optimal). If you use git clone or download a tarball, you will have to compile ESPResSo+ yourself, which might lead to better performance.

Using docker:

# docker pull espressopp/espressopp
# docker run -it espressopp/espressopp /bin/bash

Using git:

# git clone https://github.com/espressopp/espressopp.git

Alternatively, you can download a tarball or zip file of previous release versions of ESPResSo++.

QUICKINSTALL:

# cd espressopp
# cmake -DEXTERNAL_BOOST=OFF -DEXTERNAL_MPI4PY=OFF .
# make -j2
# source ESPRC

After building go to the examples directory and have a look at the python scripts.

DOCUMENTATION:

Documentation for the developer version of ESPResSo++ is at:

http://espressopp.github.io

Documentation for release versions from v1.9.4.1 onward is at:

http://espressopp.github.io/vXXX

where XXX is the version number, e.g.:

http://espressopp.github.io/v1.9.4.1

ISSUES:

Report bugs on the github issues site

Build Status Code Climate codecov.io Analysis Status

espressopp's People

Contributors

stuehn avatar junghans avatar brandest avatar niktre avatar jkrajniak avatar govarguz avatar acfogarty avatar pdebuyl avatar tbereau avatar jnvance avatar songbin6280 avatar jsmrek avatar gdeichmann avatar pgemuende avatar ppkk avatar vitst avatar

Watchers

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