nbehrnd

Results 55 issues of nbehrnd

The webpage https://babluboy.github.io/bookworm/#install explicitly describes Python2 as dependency (first bullet list, and the command for the CLI to let `apt` resolve all dependencies in one run). There is no obvious...

First time user to install and run the program as it is provided by `synaptic` in Linux Debian 12/bookworm (current branch testing) ([tracker](https://tracker.debian.org/pkg/bookworm)). + If an installation from `synaptic` and...

**Avogadro version:** - Avogadrolibs: 1.98.1 in the nightly built AppImage for Linux, packaged 2024-02-08 22:14, `md5sum` is `d6b0578d68f58a067ff0de74362b2aee Avogadro2.AppImage.zip` - Qt: 5.15.2 **Desktop version:** - OS: Linux Debian 13/trixie, branch...

**Is your feature request related to a problem? Please describe.** Drawing inspiration from [datawarrior](https://openmolecules.org/datawarrior/index.html) I wonder if processing .sdf with atomic flexibility, i.e. a particular atom could be either a...

- [x] This is a feature request ## Environment Information Open Babel version: 3.1.0 Operating system and version: Linux Debian 10 ## Expected Behavior I would like to suggest the...

## Description At present, the badge reporting the packaging statuses in the OSes considers 29 releases. A layout of six columns, check card like, arguably is easier to read, than...

## Describe the Enhancement: If running the handy `mdl -h` (perhaps second best alternative, `mdl -v`) I would like to see the program's full name/GitHub repository as contact address. Examples...

enhancement

The script requires RDKit, hence file requirements.txt should note it.

When setting up a new action, GitHub offers a couple of workflows ready for use. By search with keyword `pandoc`, there however is no example yet which would either +...

Observation: At present, githug as available on [rubygem](https://rubygems.org/gems/githug) is version 0.5.0 which is an upload by November 13, 2016. On the other hand, the last commit to the repository here...