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# Contribute content
## Contributor/requester
> Contact information about the person contributing/requesting the data. Used for communication purposes.
**Name**: Josh Vita
**Email**: vita…
jvita updated
11 months ago
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Hello there,
For a current project, I need to be able to import thousands of molecules and control them (Empties are welcome for that matter) according to a simulation a scientist provided me with.
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**Submitting author:** @gezelter (J. Daniel Gezelter)
**Repository:** https://github.com/OpenMD/OpenMD/
**Branch with paper.md** (empty if default branch):
**Version:** v3.1
**Editor:** @srmnitc
**Re…
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**Meeting Zoom link:** https://ucl.zoom.us/j/99880132263
**Topic:** Nsp13 Monthly Meeting UCL/UNC/Astex.
**Time:** Apr 4, 2022 05:00 PM London (BST), UNC 12:00 noon.
**Chair:** Tom Knight
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It seems that the unit for the mass in MDAnalysis is missing. Should be unified atomic mass unit.
```rst
=========== ============== ===============================================
quantity uni…
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## Describe the solution you'd like ##
In GROMACS's `rdf` analysis script, there is an option to calculate with only the x- and y-coordinates (`-xy`). This is not as simple as zeroing the z-coordinat…
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We've gotten some good responses on our survey (https://github.com/deepchem/deepchem/issues/1722) about the future of DeepChem, and are starting to think about synthesizing the responses together. As …
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Publications pages should include the figures from the papers. See below script:
```
import fitz # PyMuPDF
import os
def extract_images_and_captions(pdf_path, output_directory):
doc = fitz.open…
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Dear developers, now I want to define a sinusoidal electric field, I followed the comments in issue #3066. The static electric field works well, but what should I do to import **Simulation Time** to t…
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Hi everyone,
I'm getting this error (ValueError: unitcell angle < 0) when saving trajectories.
It happens with different trajectory formats and it is quite random since sometimes it happens and so…