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**Submitting author:** @AndresRTejedor (Andrés R. Tejedor)
**Repository:** https://github.com/AndresRTejedor/Mold
**Branch with paper.md** (empty if default branch): joss
**Version:** LAMMPS 2023
**Ed…
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**Submitting author:** @rohskopf (Andrew Rohskopf)
**Repository:** https://github.com/FitSNAP/FitSNAP
**Branch with paper.md** (empty if default branch):
**Version:** 3.0.1
**Editor:** @jmschrei
**Re…
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Hi, I am Koushik,
I am trying to install SchNarc, After successful installation following the guide at the readme, I face an issue while running the ../run_schnarc.py code. Many of the schnetpack mod…
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python3 chat_paper.py --query "polyimide" --filter_keys "polyimide" --max_results 3
Key word: reinforcement learning
Query: polyimide
Sort: SortCriterion.Relevance
all search:
0 Determination of …
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**Submitting author:** @pastewka (Lars Pastewka)
**Repository:** https://github.com/libAtoms/matscipy
**Branch with paper.md** (empty if default branch):
**Version:** 0.8.0
**Editor:** @diehlpk
**Rev…
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Hello everyone. I ran into the problem that the per_atom_output_key in the Atomwise module (https://github.com/atomistic-machine-learning/schnetpack/blob/3f6eecee4b35ea5bb6e5f883ae70b789f2bd3e75/src/s…
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Hi,
I'm experiencing some dependency conflicts and the installation instructions for the repository might need updating. `schnetpack` 2.0.0 requires `pytorch-lightning>=1.8.1` but `pytorch_lightni…
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**Submitting author:** @rohskopf (Andrew Rohskopf)
**Repository:** https://github.com/FitSNAP/FitSNAP
**Branch with paper.md** (empty if default branch):
**Version:** 3
**Editor:** @jmschrei
**Review…
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What is the exact version number of pytorch, pytorch_lightning, hydra-core, hydra-colorlog, ase, python? Can you provide the exact version number for us. I used the setup.py, but got lots of Error bec…
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貼吧活動：(請查閱 [SARS-CoV-2 Timeline by 2020.02.21](https://github.com/agorahub/_meta/blob/agoran/theagora/sari/Memorandum_2020-02-21_SARS-CoV-2-Timeline_Nathan.pdf?raw=true), by Nathan :cloud: )
- Colla…