Communicate ChEMBL27 with rdkit postgres cartridge and sqlalchemy #RDKit #ChEMBL #Postgres #razi

As you know ChEMBL 27 was released recently, thanks great effort for EBI ;) Fortunately ChEMBL provides common DB format dump file and RDKit has postgres DB cartridge. It means that you can search compound with rdkit functionality in postgres. BTW, to handle the database, sqlalchemy which is ORMapper is very useful. So is itContinue reading “Communicate ChEMBL27 with rdkit postgres cartridge and sqlalchemy #RDKit #ChEMBL #Postgres #razi”

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