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openbabel:Fix1830

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Last commit made on 2018-09-10
Get this branch:
git clone -b Fix1830 https://git.launchpad.net/openbabel

Branch merges

Branch information

Name:
Fix1830
Repository:
lp:openbabel

Recent commits

290833e... by baoilleach

Support lone pair stereo on nitrogen as well as sulfur

081cdd8... by Geoff Hutchison <email address hidden>

Merge pull request #1882 from mkrykunov/patch-1

Update qeq.txt

161021f... by mkrykunov <email address hidden>

Update qeq.txt

I think that Pb3 (lead) was a typo in the qeq.txt file. So it should be just Pb.

fa34a74... by baoilleach

Merge pull request #1880 from openbabel/revert-1870-FirstLast

Revert "Updates to SMILES options to specify first and last atoms when writing"

181b1ba... by baoilleach

Revert "Updates to SMILES options to specify first and last atoms when writing"

c9c5003... by Geoff Hutchison <email address hidden>

Use standardized -xk and -xf flags for handling program keywords

7fa98cb... by Geoff Hutchison <email address hidden>

Merge pull request #1873 from ghutchis/build-obmm

Rebuild OBMM tool for interactive MM optimization

a8a1e58... by Geoff Hutchison <email address hidden>

Merge pull request #1870 from baoilleach/FirstLast

Updates to SMILES options to specify first and last atoms when writing

f42eef5... by Geoff Hutchison <email address hidden>

Rebuild OBMM tool for interactive MM optimization

(Useful for Avogadro2 and Jupyter energies, etc.)

76d9832... by Geoff Hutchison <email address hidden>

Merge pull request #1836 from baoilleach/smilesrxn

Implement reaction handling as part of OBMol