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compsciencelab
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mdCATH

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molecular dynamics

neural network potential

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AntonioMirarchi commited on Jul 18, 2024

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@@ -29,7 +29,7 @@ Antonio Mirarchi, Toni Giorgino, Gianni De Fabritiis. "mdCATH: A Large-Scale MD
 | Description          | Value        |
 |:---------------------|:-------------|
 | Domains               | 5,398       |
-| Trajectories          | 134,925     |
 | Total sampled time    | 62.6 ms     |
 | Total atoms           | 11,671,592  |
 | Total amino acids     | 740,813     |

 | Description          | Value        |
 |:---------------------|:-------------|
 | Domains               | 5,398       |
+| Trajectories          | 134,950     |
 | Total sampled time    | 62.6 ms     |
 | Total atoms           | 11,671,592  |
 | Total amino acids     | 740,813     |