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**Describe the bug**
The viewer stops working when iron atoms are in the system and spheres spec has 'scale' property.
**To Reproduce**
Steps to reproduce the behavior:
1. Download an sdf fil…
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Recently I've wanted to start running some OpenMM simulations using the iAMOEBA water model. I've been running into a problem that energy minimizations and dynamics are giving me errors where the par…
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> What application are you using?
Data Tracker
> Describe the problem.
On the Flashing Beacon page, I try to search for the term "RRFB" and get zero results. However, if I manually sort them I f…
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**Describe the bug**
The vdW handler currently sets the charges of all atoms to be zero, including those that have had their charge re-distributed by a virtual site.
**To Reproduce**
```
from …
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When calling `ts-auto-guard`, all of the index.ts file that exported the type with `/** @see {...} ts-auto-guard:type-guard */` has their own index.guard.ts
Similar issue to https://git…
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Created **venv_eli** Python virtual environment running `virtualenv venv_eli`. Activated the environment and run:
`pip install git+https://github.com/muon-spectroscopy-computational-project/pymuon-s…
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Hi,
I am using D3 correction, should I manually set C6 parameters or use the default value?
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Some users are getting an error when they try to sign in to the Data Tracker with their COACD credentials in Chrome.
Please work with Billy Howland to reproduce the issue (#2110).
From a user who ex…
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# TODOS:
- [x] Rearrange and expand user guide (#428)
- [ ] Polish examples
# Explanation
Hey @mattwthompson I've just gone through the protein-ligand example from #328 - It looks really good!…
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Trial: Does this simplify application of instantiation?