AntonioMirarchi commited on
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ad8ef48
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1 Parent(s): 9e2c540

update units of the model

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  1. README.md +3 -3
README.md CHANGED
@@ -59,11 +59,11 @@ Inputs must therefore be prepared using the same AMARO mapping and bead-type ass
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  * `energy`: learned effective potential for each system
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  * `forces`: negative gradient of the effective potential with respect to bead positions
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- The model was trained against forces expressed in:
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  ```text
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- kcal mol⁻¹ Å⁻¹
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- ```
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  Because the model was trained using force labels without energy labels, its absolute energy reference is not physically calibrated.
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  * `energy`: learned effective potential for each system
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  * `forces`: negative gradient of the effective potential with respect to bead positions
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+ The model uses units of:
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  ```text
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+ kcal/mol for forces and Å for coordinates
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+ ```
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  Because the model was trained using force labels without energy labels, its absolute energy reference is not physically calibrated.
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