Uploads by Matteo
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This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 03:13, 23 February 2017 | InputFiles ABFE GMX2016.zip (file) |  |
922 KB | 3 | |
| 04:50, 20 February 2017 | Cp xvg.sh.zip (file) | |
301 bytes | simple example script to add to the tutorial "Absolute Free Energy Calculations - Gromacs 2016" | 1 |
| 04:43, 20 February 2017 | Results HREX ABFE GMX2016.zip (file) | |
113 KB | Example alchemical_analysis.py results (sims with HREX) for the tutorial "Absolute Binding Free Energy - Gromacs 2016" | 1 |
| 04:39, 20 February 2017 | Results ABFE GMX2016.zip (file) | |
209 KB | Sample results for the tutorial "Absolute Binding Free Energy - Gromacs 2016" | 1 |
| 04:26, 20 February 2017 | Therm cycle.pdf (file) |  |
1.02 MB | png | 2 |
| 14:42, 16 June 2014 | T4+nphenylglicinonitrile complex.results.doc (file) | |
5 KB | 2 | |
| 09:13, 14 June 2014 | InputFiles T4 lysozyme+nphenylglicinonitrile.tar.gz (file) | |
976 KB | 2 | |
| 05:24, 14 March 2014 | T4+nphenylglicinonitrile ligand.results.doc (file) | |
3 KB | Summary of results for the ligand in water calculations in the tutorial GROMACS 4.6. n-phenylglicinonitrile with T4 lysozyme | 1 |
| 05:06, 14 March 2014 | Absolute n-phenylglicinonitrile T4 lysozyme cycle.pdf (file) |  |
612 KB | .png version | 2 |