ejy commited on
Commit
cb09d1c
·
verified ·
1 Parent(s): 5382a14

Update README.md

Browse files
Files changed (1) hide show
  1. README.md +4 -4
README.md CHANGED
@@ -29,14 +29,14 @@ Steps to prepare the database:
29
 
30
  ```bash
31
  # Download all ZINC20 tranches from 'in-stock, lead-like' subset
32
- !mkdir zinc
33
- !wget -i ZINC-downloader-2D-smi.uri -P zinc
34
 
35
  # Remove first line of every file and save into txt file
36
- !for i in zinc/*; do tail -n +2 "$i" > "$i".txt; done
37
 
38
  # Concatenate all created files into one (contains 4015274 ligands)
39
- !cat zinc/*.txt > zinc_all.txt
40
  ```
41
 
42
  3) Parse the concatenated text file into a Huggingface dataset
 
29
 
30
  ```bash
31
  # Download all ZINC20 tranches from 'in-stock, lead-like' subset
32
+ mkdir zinc
33
+ wget -i ZINC-downloader-2D-smi.uri -P zinc
34
 
35
  # Remove first line of every file and save into txt file
36
+ for i in zinc/*; do tail -n +2 "$i" > "$i".txt; done
37
 
38
  # Concatenate all created files into one (contains 4015274 ligands)
39
+ cat zinc/*.txt > zinc_all.txt
40
  ```
41
 
42
  3) Parse the concatenated text file into a Huggingface dataset