Radical Stabilization Energies for Enzyme Engineering – Tackling the Substrate Scope of the Radical Enzyme QueE: QM input and outputs
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https://figshare.com/articles/dataset/Radical_Stabilization_Energies_for_Enzyme_Engineering_Tackling_the_Substrate_Scope_of_the_Radical_Enzyme_QueE_QM_input_and_outputs/7923659
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资源简介：
QM calculation structures and output files for RSE calculations of alternative substrates as listed in publication(Gaussian outputs are truncated by time information to be in compliance with the company's restrictions on sharing calculation data)
创建时间：
2019-03-29
