GitHub - cbc-univie/TEAPUN: ToolExtensionAssemblingPolymersforUsageinNVT-Simulations: Python Utility using charmm and openmm to create and equilibrate coarse grained (solvated) polymer systems

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ToolExtensionAssemblingPolymersforUsageinNVT-Simulations: Python Utility using charmm and openmm to create and equilibrate coarse grained (solvated) polymer systems

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Name	Name	Last commit message	Last commit date
Latest commit almarashi95 misc Apr 28, 2023 11a8808 · Apr 28, 2023 History 23 Commits
testing_files	testing_files	new testing files	Mar 24, 2023
.gitignore	.gitignore	update	Apr 20, 2023
PolymerChain.py	PolymerChain.py	misc	Apr 28, 2023
misc.py	misc.py	misc	Apr 28, 2023
polymer_builder.py	polymer_builder.py	updated example	Apr 20, 2023
simulation_details.py	simulation_details.py	fixed imports and seq relax	Mar 31, 2023
topo.py	topo.py	xml-writer; nbfix for bmh	Mar 29, 2023

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ToolExtensionAssemblingPolymersforUsageinNVT-Simulations: Python Utility using charmm and openmm to create and equilibrate coarse grained (solvated) polymer systems

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