-
- [ ] output dielectric properties not shown - extra tab. see also: https://github.com/mikibonacci/aiidalab-qe-vibroscopy/issues/39
- [x] Raman and IR in the same output, can choose what to plot on …
-
Hello,I recently encountered some issues porting Bluez to Linux system.
My Linux kernel version is 4.4.19 and bluez version is 5.60
When I used the IOS system phone to connect to the Bluetooth on my…
-
## Summary
> Please give a short summary of this research topic.
Various blockchain systems adopt distinct architectures, including different consensus mechanisms such as Proof of Work (PoW), Proo…
-
Dear OpenMM team,
I am looking for a package/tutorial to do protein-protein binding free energies. I have found plenty of alchemical methods for protein-ligand but none for protein-protein. Any poi…
-
We are currently adding additional radiation exposure classes to RBO, e.g.
![image](https://github.com/EnvironmentOntology/envo/assets/223469/fdc97488-0e65-497c-bce0-5ee3b1fd5d00)
Our radiation …
-
## Describe the feature you'd like to see
The demand inputs shall be improved.
In particular some options may be:
- [ ] (mid-term/difficult) Create/use a more advanced demand data package (e.…
-
```
What steps will reproduce the problem?
1.The application fails to open
What is the expected output? What do you see instead?
The application fails to open. It switches between the applications op…
-
Hi everyone,
I'm conducting Solvation Free Energy calculations using QCG for several macromolecules in 100 solvent molecules. I'm curious if it's feasible to employ the GFN-FF method for the Final Ge…
-
```
What steps will reproduce the problem?
1.The application fails to open
What is the expected output? What do you see instead?
The application fails to open. It switches between the applications op…
-
Awesome tool!
I enjoyed playing around with this, and discovering a mix that would get to zero carbon emissions, but it relies heavily on nuclear while having a substantial excess of wind:
I…