Rubén Ballester Bautista

Antes que nada, perdona pero no sé separar los commits para poner un aporte separado del resto, lo siento :( En cuanto a lo demás, todo cumplido, módulos basados en...

In the function `incidence_to_adjacency` of the file `toponetx/utils/structure.py` the documentation says that the default value for the parameter `s` is one, but it turns out that the default parameter is...

A simplicial complex has dimension equal to the size of its maximal s…

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A simplicial complex has dimension equal to the size of its maximal set minus one. If, for example, a simplicial complex has dimension one, then, it has simplices of at...

No backend type associated with device type cpu

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## 🐛 Bug Metrics (predefined in library and custom implementations) using concatenation `dist_reduce_fx="cat"` and CPU computation `compute_on_cpu=True` raise an error when training in multiple GPUs (`ddp`). The concrete error is...

GPSConv structural encodings.

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### 🚀 The feature, motivation and pitch In the original implementation of the GPSLayer (found in [graphgps/layer/gps_layer.py](https://github.com/rampasek/GraphGPS/blob/main/graphgps/layer/gps_layer.py#L204)), structural encodings for edges are used in the multi-head attention block. Specifically, structural...

Dear OGB team, I have detected that the smiles included in the lsc-pcqm4mv2: 'O[Si]123O[Si]3(O1)(O2)O' (position 51128) in the dataset is an invalid smiles string according to the newest versions of...