MOFid v1.1.0 (with singularity)

This release packages the mofid components (openbabel, C++ code, Python wrapper, Systre + java) into a singularity container to facilitate portability across HPC environments. The repo also provides alternate installation methods, such as a Dockerfile and instructions for compiling the C++ code without containerization software.

Initial release

This is the initial release of MOFid that accompanies submission of the corresponding manuscript.