[PRE REVIEW]: MACE: a Machine-learning Approach to Chemistry Emulation

[editorialbot]

Submitting author: !--author-handle-->@silkemaes<!--end-author-handle-- (Silke Maes) Repository: https://github.com/silkemaes/MACE Branch with paper.md (empty if default branch): JOSS Version: v1.0.0 Editor: Pending Reviewers: Pending Managing EiC: Dan Foreman-Mackey

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[editorialbot]

Reference check summary (note 'MISSING' DOIs are suggestions that need verification):

OK DOIs

- 10.1051/0004-6361/202140357 is OK
- 10.1051/0004-6361/202039956 is OK
- 10.48550/arXiv.2312.06015 is OK
- 10.1017/S1743921322000217 is OK
- 10.1126/science.abb1229 is OK
- 10.1051/0004-6361/202140431 is OK
- 10.1051/0004-6361/202140823 is OK
- 10.1051/0004-6361/202141161 is OK
- 10.1111/j.1365-2966.2006.10625.x is OK
- 10.48550/arXiv.2405.03274 is OK

MISSING DOIs

- No DOI given, and none found for title: torchode: A Parallel ODE Solver for PyTorch

INVALID DOIs

- None

[editorialbot]

Software report:

github.com/AlDanial/cloc v 1.90  T=0.04 s (813.4 files/s, 142190.8 lines/s)
-------------------------------------------------------------------------------
Language                     files          blank        comment           code
-------------------------------------------------------------------------------
Python                          17            807            938           1485
Jupyter Notebook                 3              0           1138            359
TeX                              1             11              0            175
Markdown                         2             42              0             78
TOML                             1              7              4             47
YAML                             2              6             11             34
JSON                             2              0              0             25
reStructuredText                 2             34             19             24
-------------------------------------------------------------------------------
SUM:                            30            907           2110           2227
-------------------------------------------------------------------------------

Commit count by author:

   334  Silke Maes
     1  Frederik De Ceuster

[editorialbot]

Paper file info:

📄 Wordcount for paper.md is 1057

✅ The paper includes a Statement of need section

[editorialbot]

License info:

🟡 License found: GNU General Public License v3.0 (Check here for OSI approval)

[editorialbot]

:point_right::page_facing_up: Download article proof :page_facing_up: View article proof on GitHub :page_facing_up: :point_left:

[dfm]

@silkemaes — Thanks for your submission! All the suitable JOSS editors are currently working at capacity so I'm going to "waitlist" this review until an editor with the relevant expertise is available to take it on. Thanks for your patience!