From 10dc2ebb982057da6501d6072f165fe21061483e Mon Sep 17 00:00:00 2001 From: Christoph Helma Date: Tue, 6 Nov 2018 19:00:37 +0100 Subject: sdf export fixed, cleanup --- Makefile | 7 +++++-- 1 file changed, 5 insertions(+), 2 deletions(-) (limited to 'Makefile') diff --git a/Makefile b/Makefile index 4573cd0..f530743 100644 --- a/Makefile +++ b/Makefile @@ -1,6 +1,6 @@ summaries = summaries/mutagenicity-merged-crossvalidations.json summaries/carcinogenicity-crossvalidations.json summaries/pa_mutagenicity_neighbor_sets.json summaries/pa_carcinogenicity_neighbor_sets.json -exports = export/mutagenicity-merged.sdf export/pa_mutagenicity.csv export/pa_carcinogenicity.csv +exports = export/mutagenicity-merged.sdf export/mutagenicity-merged.csv export/pa_mutagenicity.csv export/pa_carcinogenicity.csv all: $(summaries) $(exports) @@ -20,8 +20,11 @@ summaries/carcinogenicity-crossvalidations.json: models/carcinogenicity.id # exports +export/mutagenicity-merged.csv: data/mutagenicity-merged.id + scripts/export.rb $< csv > $@ + export/mutagenicity-merged.sdf: data/mutagenicity-merged.id - scripts/export-sdf.rb $< > $@ + scripts/export.rb $< sdf > $@ export/pa_mutagenicity.csv: data/pa_mutagenicity.json scripts/json2csv.rb $< > $@ -- cgit v1.2.3