Molecular simulations of porphyrins and
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John A. Shelnutt
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Article
📅
2000
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John Wiley and Sons
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English
⚖ 56 KB
👁 2 views
An overview of the use of classical mechanical molecular simulations of porphyrins, hydroporphyrins and heme proteins is given. The topics cover molecular mechanics calculations of structures and conformer energies of porphyrins, energies of barriers for interconversion between stable conformers, mo