From 8aba39607e4cdc1bfbc0b4ac09166bfb9915a625 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Herv=C3=A9=20M=C3=A9nager?= <herve.menager@pasteur.fr> Date: Tue, 26 May 2020 12:28:11 +0200 Subject: [PATCH] automatically retrieve ChEMBL-PubChem cross-links in Compounds --- ippisite/ippidb/models.py | 2 ++ 1 file changed, 2 insertions(+) diff --git a/ippisite/ippidb/models.py b/ippisite/ippidb/models.py index 8138bda5..58fadb86 100644 --- a/ippisite/ippidb/models.py +++ b/ippisite/ippidb/models.py @@ -999,6 +999,8 @@ class Compound(AutoFillableModel): self.inchikey = smi2inchikey(self.canonical_smile) self.compute_drugbank_compound_similarity() self.set_drugbank_link() + self.set_chembl_link() + self.set_pubchem_link() self.save() def set_drugbank_link(self): -- GitLab