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This is a new xml based data source from nextprot - early in development, and open to feedback about how they structure their data. Have been working with Pascale Gaudet.
The data represent curated …
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## Bug report
#### Description
Demo container not building in binder
```
Removing intermediate container f8f6e2fb55fc
Step 25/27 : USER ${NB_USER}
---> Running in cf2a7e8109e6
---> 6a08…
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Maybe we should update the README.md to briefly explain why we're talking about introducing a new file format in order to make it easier to bring the community in for discussion. Right now, people com…
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Hi, I am trying to run workflow "A multivariate EBNM approach for mixture multivariate distribution estimate" with Minimal working example approach, but at initial step in the following command I am g…
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## *Hosting Details*
*The Request will be deployed Molecular Absorption Spectroscopy Lab*
**Request Type**:
- [ ] Urgent
#### Note: All of the following request parameters are mandatory. Pleas…
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Opened issue to list here other Python libraries to be checked.
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ChEBI stands for chemical entities of *biological interest*. It's not clear why the top level contains groupings like p-block which AFAICT have of no interest to biologists
This leads to massively …
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# Abstract
Computing the excited states of molecules is essential to the understanding of photochemical reactions and in turn to the design of new materials for e.g. solar cells. Last year the qEOM a…
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Hi Chris and team,
Sebastian from Andrew Su's lab here. We have been working out a set of drug to disease relations which we plan on integrating into Wikidata. As far as I could see, such terms do …
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Calculate the center of mass for each species (3D vector) and its momentum (an other 3D vector).
Quite interesting for mass limited targets.