ENH: Do not abort fast-sigma computations if a crash is encountered for a single property

[BvB93]

cc @juliette1996

[codecov]

Codecov Report

Merging #126 (0d7ceb6) into master (1f88974) will decrease coverage by 13.27%.
The diff coverage is 9.37%.

@@             Coverage Diff             @@
##           master     #126       +/-   ##
===========================================
- Coverage   61.62%   48.35%   -13.28%     
===========================================
  Files          36       36               
  Lines        2898     2881       -17     
===========================================
- Hits         1786     1393      -393     
- Misses       1112     1488      +376     

Impacted Files	Coverage Δ
nanoCAT/recipes/fast_sigma.py	41.09% <9.37%> (+2.26%)	⬆️
nanoCAT/ff/cp2k_utils.py	13.79% <0.00%> (-86.21%)	⬇️
nanoCAT/asa/asa_frag.py	16.66% <0.00%> (-83.34%)	⬇️
nanoCAT/bde/bde_workflow.py	14.70% <0.00%> (-69.86%)	⬇️
nanoCAT/qd_opt_ff.py	20.58% <0.00%> (-69.61%)	⬇️
nanoCAT/bde/construct_xyn.py	16.49% <0.00%> (-63.92%)	⬇️
nanoCAT/ff/ff_assignment.py	31.11% <0.00%> (-51.12%)	⬇️
nanoCAT/ff/match_job.py	31.19% <0.00%> (-37.62%)	⬇️
nanoCAT/asa/md_asa.py	19.65% <0.00%> (-33.34%)	⬇️
nanoCAT/asa/asa.py	17.43% <0.00%> (-6.43%)	⬇️
... and 2 more

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