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**Describe the solution you'd like**
Galaxy for CompChem and Cheminformatics set up on the ilifu research compute using CloudMan.
**Somethings that need attending to**
- [ ] Galaxy must run on …
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This is the big question: how is data laid out inside the JSON structure?
The best working example currently comes from @jchodera on slack:
``` javascript
{name:'molecule name',
type:'molecule',
p…
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@matteoferla knows something about this - link up with Tim and Jenke
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I will like to request that AmberMD (http://ambermd.org/) as a package be part of the compchem galaxy tools. It provides special features for nucleic acid simulation.
Thanks