Package: python-indigo Version: 1.0.0-2 Severity: normal Dear debichem maintainers,
Upstream has indigo 1.1.5, and since 1.1.3 they use the Hill convention for their GrossFormula function. It would be great if the latest upstream version could be packaged, because the molecular formulas given by 1.0.0 are not what would be expected and therefore the GrossFormula function does not completely fulfil its purpose. Maybe it is worth to mention that indigo works very nicely for me apart from this. It is great for generating standardised structure representations from SMILES codes, calculating molecular weights to go with it and I am sure for many other chemoinformatics tasks. Kind regards, Johannes Ranke P.S.: I am actually using python-indigo and indigo-utils at work on a Debian stable system, so you can ignore the system information given below. -- System Information: Debian Release: wheezy/sid APT prefers precise-updates APT policy: (500, 'precise-updates'), (500, 'precise-security'), (500, 'precise'), (100, 'precise-backports') Architecture: amd64 (x86_64) Kernel: Linux 3.2.0-31-generic (SMP w/3 CPU cores) Locale: LANG=de_DE.UTF-8, LC_CTYPE=de_DE.UTF-8 (charmap=UTF-8) Shell: /bin/sh linked to /bin/dash -- To UNSUBSCRIBE, email to debian-bugs-dist-requ...@lists.debian.org with a subject of "unsubscribe". Trouble? Contact listmas...@lists.debian.org