madscatt / zazzie

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GNU General Public License v3.0
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energy_minimization, monomer_monte_carlo, complex_monte_carlo #69

Closed skrueger111 closed 7 years ago

skrueger111 commented 7 years ago

Initial 2.0 code and tests are finished for the above modules. Development progress document has been modified (for some reason it showed up twice, maybe because I had to "pull" it to my local computer and then commit in order to make git happy).

Note that I had to change sasconfig.py to run the tests for both monte carlo programs. I had to add a definition for __bin_path. I added it at the end and didn't change anything else. I ran a few other tests (align, data_interpolation, density_plot) and they ran fine. All modules check sasconfig for level__ = 'DEBUG', so my addition didn't break that.