faq
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faq [2018/12/19 01:40] – flack | faq [2018/12/19 10:14] – flack | ||
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To split a smi.gz / smiles.gz file into multiple **gzip compressed chunks** use a command like this: | To split a smi.gz / smiles.gz file into multiple **gzip compressed chunks** use a command like this: | ||
< | < | ||
- | gzip -dc your.smi.gz | split --verbose --lines=< | + | gzip -dc your.smi.gz | split --verbose --lines=< |
</ | </ | ||
For example to split the Mcule Purchasable (Full) smi.gz file into 1M **gzip compressed chunks** use: | For example to split the Mcule Purchasable (Full) smi.gz file into 1M **gzip compressed chunks** use: | ||
< | < | ||
- | gzip -dc mcule_purchasable_full_180817.smi.gz | split --verbose --lines=1000000 --numeric-suffixes --suffix-length=10 --additional-suffix=' | + | gzip -dc mcule_purchasable_full_180817.smi.gz | split --verbose --lines=1000000 --numeric-suffixes --suffix-length=10 --additional-suffix=' |
</ | </ | ||
faq.txt · Last modified: 2024/04/09 08:33 by rkiss