new structure

.dockerignore

.gitmodules

3rdparty/condor

3rdparty/gap-py2/LICENSE.md

3rdparty/gap-py2/Makefile

3rdparty/gap-py2/clustering.f95

3rdparty/gap-py2/descriptors.f95

3rdparty/gap-py2/descriptors_wrapper.f95

3rdparty/gap-py2/error.inc

3rdparty/gap-py2/gap_fit.f95

3rdparty/gap-py2/gap_fit_module.f95

3rdparty/gap-py2/gapversion

3rdparty/gap-py2/gp_fit.f95

3rdparty/gap-py2/gp_predict.f95

3rdparty/gap-py2/make_permutations_v2.f95

3rdparty/gap-py2/teach_sparse

3rdparty/gap/.gitignore

3rdparty/gap/LICENSE.md

3rdparty/gap/Makefile

3rdparty/gap/clustering.f95