About distribution of angles and dihedral angels

pengxingang / Pocket2Mol

Pocket2Mol: Efficient Molecular Sampling Based on 3D Protein Pockets

MIT License

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Open ljl123ljl opened 1 year ago

ljl123ljl commented 1 year ago

Hi, wonderful work! I wonder if the mols generated follow the same angle distribution and dihedral angel distribution with real mols.

pengxingang commented 1 year ago

Yes, Pocket2Mol can generate molecules with similar distributions of bond angle and dihedral angle with the real molecules.