Open Babel

openbabel:moreagents

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  2. lp:openbabel
  3. moreagents
Last commit made on 2017-09-15
Get this branch:
git clone -b moreagents https://git.launchpad.net/openbabel

Branch merges

Branch information

Name:
moreagents
Repository:
lp:openbabel

Recent commits

bb1e05e... by baoilleach

Remove final reference to original _agent

d6e3b32... by baoilleach

Change OBReaction to support multiple agents instead of just one

646f579... by Geoff Hutchison <email address hidden>

Merge pull request #1593 from keipertk/master

Change silicon to correct MM3 atom type

cf8a221... by Kristopher Keipert <email address hidden>

Change silicon to correct MM3 atom type

9359f9e... by baoilleach

Merge pull request #1578 from afonari/patch-14

Parse _space_group_symop_operation_xyz in mmcif

f460d04... by baoilleach

Merge pull request #1586 from mwojcikowski/fix-msvc

Introduce std:isnan for older versions of MSVC

ac0fd29... by =?utf-8?q?Maciej_W=C3=B3jcikowski?= <email address hidden>

Merge pull request #1 from baoilleach/my_fix-msvc

Define OB_ISNAN to handle differences between MSVC versions

357bde1... by baoilleach

Define OB_ISNAN to handle differences between MSVC versions

829aa40... by Geoff Hutchison <email address hidden>

Merge pull request #1589 from baoilleach/smilesatomtypes

Improve performance of SMILES parser

360669b... by baoilleach

Merge pull request #1588 from barrymoo/prepend_to_ld_library_path

Prepend to LD_LIBRARY_PATH instead of overwrite