Oxydation of the chromophore group in Venus66azF. Structures at minima on the potential energy surface.
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https://zenodo.org/record/8327919
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资源简介：
Minima on the potential energy surface obtained at the QM(PBE0-D3/6-31G*)/MM(AMBER) level.
Th reaction path is REAC ->INT1 -> INT2 -> PROD
创建时间：
2023-09-09
