Kishalay Das (KD)

code in pytorch?

2

Hello, Is there any version of this code available in PyTorch? I am not much comfortable with TensorFlow, so if I get a torch version it would have been really...

Train the model for customised train-test split

4

I have around 40K crystal data from the materials project database in .cif file format. I want to train the megnet model from scratch using my own train test split...

Pretrain using a new dataset

2

Hey, I want to use this pretraining strategy to pre-train the GNN model on a new chemical dataset from scratch. What I have understood from the code, all the datasets...

Indexing of Train Samples

1

Hello, First 140 nodes in cora that you are considering as Train-Samples, are those node indexes are 0-139 or something else in Adjacency Matrix?

Issue with self.get_component_makeup_summary() for few materials

3

I tried to dump textual description of a few MP crystals and found for a few crystals like 'VSe2', 'MoW3(SeS3)2', 'Mo3W(Se3S)2' etc I am getting the following error : Traceback...

Run this code without Fairseq

1

Is there any way to run this code without fairseq? I want to train tokengt with my own graph data and check the results.

Pytorch version of the code

1

Is it possible to have the torch version of the code in place of torch-ignite? I want to go deep dive into the actual code and want to make some...

Hi, How to run the code?