Advertisement · 728 × 90

Posts by Ben Krummenacher

Post image

I recently ran into horrors of mysterious atom names for Glycam force fields. There seemed to be no choice but to hand-follow bond connections from prep files, so I made this awk script to convert AMBER prep to Graphviz DOT for visualization. github.com/benfordslaw/...
Here's an N-Acetylglucosamine:

1 year ago 2 0 0 0