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An Enhanced tool to process PDB structures based on Gemmi

Project description

An Enhanced tool to process PDB structures based on Gemmi

Install

conda install python=3.12.12 anarci=2020.04.23=py_3 hmmer=3.4=h503566f_3 dockq=2.1.3 trimesh rtree pdbfixer dssp usalign openstructure -c bioconda -c conda-forge
pip install gemmi_protools

Usage

read structures

from gemmi_protools import StructureParser

# load structure
st=StructureParser()
st.load_from_file("7mmo.cif")

# get chain IDs
print(st.chain_ids)

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