File: smi_isomorphism_034.sh

package info (click to toggle)
smiles-scripts 0.3.0%2Bsvn878%2Bbranch%2Bsystem%2Bdeps-2
  • links: PTS, VCS
  • area: main
  • in suites: forky, sid, trixie
  • size: 3,860 kB
  • sloc: perl: 1,889; java: 1,218; sh: 1,092; makefile: 246
file content (4 lines) | stat: -rwxr-xr-x 296 bytes parent folder | download 
1
2
3
4
 
#!/bin/bash

echo -e "1542900\tC1(=C(C(=C(C2(=C(C(=C(C(=C12)([H]))([H]))([H]))([H])))([H]))([H]))([H]))(C(C(O([H]))([H])([H]))([H])([H])).C(C(C1(=C2(C(=C(C(=C(C2(=C(C(=C1([H]))([H]))([H])))([H]))([H]))([H]))([H]))))([H])([H]))(O([H]))([H])([H])\tC1(=CC=CC2=CC=CC=C12)CCO" \
    | smi_isomorphism