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This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | User | Description | Versions |
|---|---|---|---|---|---|---|
| 14:07, 3 June 2021 | Schrodinger.jpg (file) |  |
600 KB | Hannahbruce | 1 | |
| 14:03, 3 June 2021 | Schrodinger.pdf (file) |  |
565 KB | Hannahbruce | 1 | |
| 13:09, 23 October 2020 | BI.jpg (file) |  |
41 KB | Hannahbruce | 2 | |
| 09:57, 30 April 2020 | 1200x628--JCIM CFP FreeEnergySI-NO-Deadline.png (file) |  |
849 KB | Hannahbruce | 1 | |
| 16:03, 3 March 2020 | JCIM CFP FreeEnergySI-v22.png (file) |  |
424 KB | Hannahbruce | 1 | |
| 15:37, 20 January 2020 | Acs-comp.jpg (file) |  |
204 KB | Hannahbruce | 1 | |
| 10:43, 6 January 2020 | LillyLogo.jpg (file) |  |
120 KB | Hannahbruce | 1 | |
| 15:00, 24 December 2019 | DassaultSystemes.png (file) |  |
24 KB | Hannahbruce | 1 | |
| 05:48, 20 December 2019 | SoseiHeptares.png (file) |  |
75 KB | Hannahbruce | 1 | |
| 17:01, 25 November 2019 | Biovia.jpg (file) |  |
136 KB | Hannahbruce | 1 | |
| 09:17, 16 November 2019 | Alkermes.png (file) |  |
31 KB | Hannahbruce | 1 | |
| 17:15, 5 November 2019 | Pfizer.jpg (file) |  |
95 KB | Hannahbruce | 2 | |
| 09:36, 28 October 2019 | Playmolecule.png (file) |  |
39 KB | Hannahbruce | 2 | |
| 10:07, 16 October 2019 | Biogen.png (file) |  |
19 KB | Hannahbruce | 1 | |
| 16:47, 11 October 2019 | Jcim.jpg (file) |  |
38 KB | Hannahbruce | 1 | |
| 14:08, 8 October 2019 | CCG.png (file) |  |
49 KB | Hannahbruce | Chemical computing group high-resolution logo | 2 |
| 14:47, 11 September 2019 | Novartis.jpg (file) |  |
445 KB | Hannahbruce | 1 | |
| 10:22, 29 May 2018 | Janssen-500px.png (file) |  |
90 KB | Mjschnie | 1 | |
| 17:50, 7 May 2018 | QuantumBio 500px.png (file) |  |
28 KB | Mjschnie | 1 | |
| 16:18, 3 April 2018 | Genetech-500px.jpg (file) |  |
22 KB | Mjschnie | 1 | |
| 14:37, 29 March 2018 | Openeye-logo-large-500px.jpg (file) |  |
45 KB | Mjschnie | 1 | |
| 11:54, 19 February 2018 | AstraZeneca 500px.png (file) |  |
32 KB | Mjschnie | 1 | |
| 10:52, 19 February 2018 | Biki 500px.jpg (file) |  |
572 KB | Mjschnie | 1 | |
| 17:53, 7 February 2018 | Schrodinger 500px.png (file) |  |
25 KB | Mjschnie | 1 | |
| 17:11, 7 February 2018 | Vertex 500px.png (file) |  |
32 KB | Mjschnie | 1 | |
| 17:09, 7 February 2018 | Vertex.png (file) |  |
32 KB | Mjschnie | 3 | |
| 17:02, 7 February 2018 | Entasis Therapeutics 500px.jpg (file) |  |
60 KB | Mjschnie | 1 | |
| 17:01, 7 February 2018 | Cresset Software Logo 500px.jpg (file) |  |
68 KB | Mjschnie | 2 | |
| 16:52, 7 February 2018 | Acellera 500px.png (file) |  |
21 KB | Mjschnie | Acellera | 1 |
| 10:04, 13 September 2017 | SiliconTx.png (file) |  |
42 KB | Mjschnie | 4 | |
| 15:39, 12 September 2017 | Novartis-logo.png (file) |  |
25 KB | Mjschnie | 2 | |
| 04:13, 23 February 2017 | InputFiles ABFE GMX2016.zip (file) |  |
922 KB | Matteo | 3 | |
| 05:50, 20 February 2017 | Cp xvg.sh.zip (file) | |
301 bytes | Matteo | simple example script to add to the tutorial "Absolute Free Energy Calculations - Gromacs 2016" | 1 |
| 05:43, 20 February 2017 | Results HREX ABFE GMX2016.zip (file) | |
113 KB | Matteo | Example alchemical_analysis.py results (sims with HREX) for the tutorial "Absolute Binding Free Energy - Gromacs 2016" | 1 |
| 05:39, 20 February 2017 | Results ABFE GMX2016.zip (file) | |
209 KB | Matteo | Sample results for the tutorial "Absolute Binding Free Energy - Gromacs 2016" | 1 |
| 05:26, 20 February 2017 | Therm cycle.pdf (file) |  |
1.02 MB | Matteo | png | 2 |
| 19:13, 28 September 2016 | Vertex talk 5 15 2016 clean3.pdf (file) | |
2.81 MB | David Mobley | Robert Abel partial slides from Vertex workshop | 1 |
| 19:21, 8 June 2016 | Poster LaurentiuSpiridon.pdf (file) | |
1.42 MB | David Mobley | 1 | |
| 19:20, 8 June 2016 | Vertex FreeEnergyWorkshop2016 AV.pdf (file) | |
708 KB | David Mobley | 1 | |
| 19:19, 8 June 2016 | Vertex-workshop-Baofeng-Zhang-51316.pdf (file) | |
12.49 MB | David Mobley | 1 | |
| 22:45, 26 May 2016 | 2016 Vertex.pdf (file) | |
26.56 MB | David Mobley | Mobley's 2016 Vertex talk | 1 |
| 15:11, 20 May 2016 | YANK-tutorial-2016-05-20.pdf (file) | |
424 KB | John Chodera | YANK tutorial slides presented at 2016 Markov state models and kinetics in drug discovery workshop at Novartis. | 1 |
| 14:16, 20 May 2016 | Sampling Discussion.pdf (file) | |
36 KB | Michael Shirts | Summary of the sampling discussion on Tuesday afternoon | 1 |
| 13:09, 15 May 2016 | VertexComputationalChemist JobFlyer.pdf (file) | |
242 KB | John Chodera | Vertex - Research Scientist I, Computational Chemist/Modeling and Informatics (posted 2016-05-15) | 1 |
| 11:50, 15 May 2016 | Merck Serono postdoctoral researcher in computational chemistry and molecular dynamics.pdf (file) | |
515 KB | John Chodera | Merck Serono postdoctoral researcher in computational chemistry and molecular dynamics - 2016-05-15 | 1 |
| 11:48, 15 May 2016 | Merck Serono postdoctoral researcher for predictive models in drug design.pdf (file) | |
517 KB | John Chodera | Merck Serono postdoctoral researcher for predictive models in drug design - 2016-06-15 | 1 |
| 19:08, 10 March 2016 | Astex.png (file) |  |
6 KB | Mjschnie | 1 | |
| 19:07, 10 March 2016 | OpenEye.png (file) |  |
8 KB | Mjschnie | 1 | |
| 19:07, 10 March 2016 | Pfizer.png (file) |  |
19 KB | Mjschnie | 1 | |
| 19:01, 10 March 2016 | Laufer.png (file) |  |
7 KB | Mjschnie | 1 |
