pdb and sdf file #68
Description
Hello, I have used https://github.com/drorlab/atom3d/blob/master/examples/lba/dataset/process_pdbbind.py to reprocess the pdbbind-LBA dataset. However, I found the intercepted pockets are still different from your provided lmdb's protein structure. I am wondering if you can provide an intermediate file of pdb pocket files and the paired sdf molecules for generating the standard lmdb which can be downloaded. Thanks a lot for your help.