#sdf #hydrogen #remover

app sdf-hydrogen-remover

SDF Hydrogen remover

1 unstable release

0.1.0 Sep 26, 2021

#40 in #sdf

GPL-3.0 license

17KB
84 lines

sdf-hydrogen-remover

Building

After cloning the repository, run

cargo build --release

The result will be found in target/release/sdf-hydrogen-remover.

Changelog

0.1.0

  • Implemented removing hydrogen atoms from a single SDF, containing a single compound.

Dependencies

~1.5MB
~24K SLoC