onionnet
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zhenglz
A multiple-layer inter-molecular contact features based deep neural network for protein-ligand binding affinity prediction
The Table S2 mentioned in paper [supporting information](https://pubs.acs.org/doi/suppl/10.1021/acsomega.9b01997/suppl_file/ao9b01997_si_001.pdf) is missing. Would you give me a copy? Thanks.
How can I training new data on onionnet? Training input files (include ki, kd, ic50 value) and command line would be appreciated.
Hi, Thanks for such a useful repository. I was trying to extract features of protein-ligand complex using generate_feature.py. But, I am getting the following error "ValueError: PDB Error: All MODELs...
