Mercurial > repos > chemteam > ambertools_acpype

view test-data/LigA_output.txt @ 9:6ca543ec1bf8 draft

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"planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit aa5e1ad9fb06855dddc66b6cdfa2e5724c251c53"
author chemteam
date Wed, 14 Jul 2021 11:28:51 +0000
parents 2e202f6c3034
children
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MASS

BOND

ANGLE

DIHE

IMPROPER
c2-ha-c2-ha         1.1          180.0         2.0          Using the default value
c2-c2-c2-os         1.1          180.0         2.0          Using the default value
c2-o -c2-o          1.1          180.0         2.0          Using the default value
c2-c3-c2-ha         1.1          180.0         2.0          Using the default value
c2-c2-c2-c2         1.1          180.0         2.0          Using the default value
c2-c2-c2-ha         1.1          180.0         2.0          Using the default value

NONBON