Automatic TI Preparation Workflow for AMBER-ANI

Name		Name	Last commit message	Last commit date
Latest commit History 7 Commits
ch005		ch005
ch006		ch006
ch008		ch008
mdin		mdin
.gitignore		.gitignore
AutoTIPrep.py		AutoTIPrep.py
LICENSE		LICENSE
README.md		README.md
group_file_template.group		group_file_template.group
leap_gas_template.in		leap_gas_template.in
leap_water_template.in		leap_water_template.in
parmed_devdw_template.in		parmed_devdw_template.in
sub_template.sh		sub_template.sh

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