jszopi / repESP

Reproducing molecular ESP from partial charges and more
GNU General Public License v3.0
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Features missing from version 0.2.0 #21

Open jszopi opened 5 years ago

jszopi commented 5 years ago

Certain features will be deliberately missing from the initial release of v0.2. The feature set had to be restricted due to a release being needed in early October. Note that a complete functionality set is available at a higher abstraction level through scripts.

This issue will document the missing features, open a place for prioritization requests and track the work on them for later patch releases.

The following is a summary of the items to be implemented in the order of current priority: