Search results

The conformation generated is 2D and how to make sure it is a proper conformer as output?

Status: Open.

#9 In DeepGraphLearning/ConfGF;

· mw742 opened on Sep 19, 2023

Multiple Conformers

Status: Open.

#8 In DeepGraphLearning/ConfGF;

· dhruv-acog opened on Feb 22, 2023

Unable to recreate the environment

Status: Open.

#7 In DeepGraphLearning/ConfGF;

· Frostday opened on Feb 17, 2023

Grad Error!

Status: Open.

#6 In DeepGraphLearning/ConfGF;

· JackAILab opened on Jan 20, 2023

An error on "Generate conformations of a molecule by feeding its SMILES into the model"

Status: Open.

#5 In DeepGraphLearning/ConfGF;

· hkqiu opened on Dec 14, 2022

"The 'data' object was created by an older version of PyG. "

Status: Open.

#3 In DeepGraphLearning/ConfGF;

· Neo-Flash opened on Feb 4, 2022

Code on property prediction experiments

Status: Open.

#2 In DeepGraphLearning/ConfGF;

· teslacool opened on Sep 27, 2021

How to generate the 3D SDF from the output?

enhancementNew feature or requestNew feature or request

Status: Open.

#1 In DeepGraphLearning/ConfGF;

· alexgcsa opened on Aug 1, 2021