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**Describe the bug**
In [the test log](https://freebsd.org/~yuri/nwchem-7.2.3-tests.log) there are many failures:
```
Running tests/esp_uhf/esp_uhf
cleaning scratch
copying input…
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Whenever a repulsion blast is triggered, the game occasionally crashes
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Could you guide how to set the training correct? Or could you please check or confirm this behaviour?
```
(PUNet10) gabby-suwichaya@gabby-suwichaya:/mnt/HDD4TB3/PU-Net_pytorch$ /home/gabby-suwich…
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Hi,
There are inconsistent descriptions of RepulsionLayer comments and the actual calculation formula.
`U_repulsion_ij = (sigma_{ij} / r_{ij}) ^ exp_{ij}`
and
```
energy = torch.sum((sel…
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### Describe the bug
### Build Information
**Chaos.exe Build Date:** 06-11-2023 22:13:42 UTC
**Server Build Date:** 06-11-2023 22:24:40 UTC
**Client Build Date:** 06-11-2023 22:24:41 UTC
**Branch…
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### Problem Statement
When Using the OpenOrd layout plugin we sometimes see an unwanted phenomenon.
"Important" nodes, with a high degree, are often obscured by their neighbours.
You can recreate …
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Hi, can you provide a model trained with repulsion loss, Thank you. @bailvwangzi
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我尝试将您提供的代码中的repulsion loss 迁移到我所用的yolov5-6.0项目中，但是出现了rep loss不参与训练的问题，每训练完一个epoch得到的各项损失及map指标都与未更改之前相同。我确保在前向传播过程中rep loss参与进来了，因为可以打印出rep损失，并且每个epoch的训练时间增加了很多，请问这是什么问题。
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Hi there,
I am using hotbit for parametrization of Cu-M (where M is another transition metal).
I am able to get the .elm and Slako tables with no repulsion.
However, when I try the fourth step …
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This is a note about something to consider in the future. In 'ggrepel' repulsion is applied during rendering, so it tracks changes in plot size. This is advantageous in some respects, but means that r…