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Instructions to turn off equivarinace? #38

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Ala1s opened this issue Mar 30, 2024 · 2 comments
Open

Instructions to turn off equivarinace? #38

Ala1s opened this issue Mar 30, 2024 · 2 comments

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@Ala1s
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Ala1s commented Mar 30, 2024

could you please share how to turn off equivariance, I would like to apply this model for my use case, where I also don't need equivariance

Originally posted by @Ala1s in #25 (comment)

@NishanthARao
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Any updates on this? Were you able to figure out how to turn off the equivariance?
Thanks!

@Ala1s
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Ala1s commented May 29, 2024

Any updates on this? Were you able to figure out how to turn off the equivariance? Thanks!

unfortunately no updates from the author, but you can use set a 'model' argument to "gnn_dynamics" instead of "egnn_dynamics", then you will be using a normal GCN as denoising networks, which works quite well in my usecase. However, I still dont completely understand the purpose of some loss terms calculated in the diffusion model so maybe something there is also ought to be removed/changed in order to improve results for non-equivariant usecase. If you figure something out regarding the loss terms, please share!

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