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### Bug summary
i am running multi trajectory mmpbsa calculations using gmx_MMPBSA. i keep getting this error
### Terminal output
```bash
$ gmx_MMPBSA -O -i mmpbsa.in -cs mmpbsa.tpr -ci index_c.ndx…
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### Problem description
In **openbabel** Only one format is showing other `formats` are missing
![Screenshot_20230813-201216](https://github.com/termux/termux-packages/assets/104101867/847fb8d9-6…
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Thank you for your great work, I am very interested in it.
I have managed to upgrade the hotprotein framework from ESM1 to ESM2, this is the [repo](https://github.com/YaoQ/HotProtein)
I finetune t…
YaoQ updated
9 months ago
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- please download and use the sequence (alpha-1-microglobulin/bikunin precursor (AMBP), mRNA):
[AMBP_protein.txt](https://github.com/kacst-bioinfo-lab/labwork/files/1203532/AMBP_protein.txt)
- Firs…
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Hi,
This non-standard structure has a broken secondary structure when loaded on PyMol.
Molstar is able to generate a secondary structure like this one
![image](https://user-images.githubusercont…
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Hi all,
stumbled upon this paper describing the mapping of PDB residue id's to the ones in the sequence deposited in Uniprot:
- Choudhary, P.; Anyango, S.; Berrisford, J.; Varadi, M.; Tolchard, …
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Workspace to provide individuals working on the FoodOn Fermentation ontology to provide an Introduction to themselves, what they perceive as the scope of the Fermentation ontology, what is the purpose…
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Looking at PMC1747177, in softcite_code_applied.csv we have `GenomeRNAi` as software name:
```
selection,coder,code,was_code_present,code_label
PMC1747177_MS02,mjsong1201,software_was_used,true,
…
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A bit of a recap from what I mentioned in the January meeting #67
I found these crystal structures from the [Protein Data Bank](https://www.rcsb.org). These provide more evidence that Fenarimol an…
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Hello,
I've found the MDM task tool very useful, however I had a query regarding the input files.
In the mdm-task-web> mdmtaskweb_tutorial.ipynb the --final file was taken from the Protein data ban…