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openbabel

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openbabel
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.

C++ · 1383 stars

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pdbqtformat gives incorrect BRANCH for large molecule Open

Difficulty 2/5 1-3 hours Newbie friendliness 68/100

openbabel/openbabel#2453 · 2 comments · Opened Feb 25, 2022

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