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## 🐛 Bug
## To Reproduce
Steps to reproduce the behavior:
1. Running the 14_Modeling_Protein_Ligand_Interactions_With_Atomic_Convolutions
2. Trying to featurize the pdbbind dataset
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Hi @zhangruochi, I've found your paper quite interesting and I think the tool is really useful. I'm considering utilising the model for one project and wanted to play a bit with it. I've been looking …
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Hi,
I wanted to ask whether it is possible to include the PAE (Predicted Aligned Error) output or Peak values, similar to those in AlphaFold, in the current analysis. Alternatively, do you have any…
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Need better tools to find what you're after.
Will need a bit more brain-picking of users.
Certainly:
* search box with look-ahead search of all fields
* sort/filter modal - push to explicit …
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Currently we don't differentiate between genes and proteins, we just lump them all under gene. However, most go annotation is at the protein level. When we have a go annotation, and we ask quickgo …
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Get SMILES for PubChem Compount (here for aspirin CID 2244):
* https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/fastidentity/cid/2244/JSON
Get AA sequence for a protein (check the sequence key)…
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Please refer to issue #25 for previous discussions using surface-plasmon resonance. This issue describes updated efforts at establishing a robust biophysical screen to confirm binders to the SARS-CoV-…
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## 1. Social Network Analysis (SNA) as a Computational Method
Description: Social Network Analysis (SNA) is a computational method that examines relationships and structures within networks. In this …
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A new panel for information about graph nodes (proteins, targets) and edges (interactions themselves) is added to the graph panel. The point is, first, remove the window when a node is clicked to disp…