Optimized structures for Optical control of ultrafast structural motion in a fluorescent protein
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https://zenodo.org/record/7887625
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QM-MM Optimized structures of the hydrogen bonding configuration in states A1, A2 and Transition State (TS) between them for rsKiiro protein on ground (s0) and first excited (s1) states. Structures were optimized at PBE0-D3/cc-pVDZ//Amber03 level.
创建时间：
2023-05-03
