使作呕 发表于 2025-3-21 19:26:28
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http://reply.papertrans.cn/17/1649/164807/164807_2.pngGenome 发表于 2025-3-22 03:36:59
,Führung ■ auf den Punkt gebracht,ity of metalloenzyme models. Some relevant aspects which have not yet been fullyexplored using theoretical methods, such as the role of antiferromagnetic coupling and photochemical reactionsin hydrogenases, are treated in more detail, with presentation and discussion of original data recentlyobtained in our laboratory.反抗者 发表于 2025-3-22 07:04:54
http://reply.papertrans.cn/17/1649/164807/164807_4.png周兴旺 发表于 2025-3-22 09:59:57
,Führung ■ auf den Punkt gebracht,ar, the continuous increase in reliability and speed ofquantum chemical methods has recently allowed the investigation of very complex molecular systems, suchas biological macromolecules. In this contribution, we present applications of quantum chemical methodsto the investigation of reaction pathsGlossy 发表于 2025-3-22 14:08:45
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Ziele und Hypothesen der Forschungsstudie mechanics in trajectory space, transition pathsampling can be applied to identify mechanisms and determine rate constants. Here we review the basic ideasand algorithms of transition path sampling and discuss some recent applications of this methodology to problemsin molecular biology including protDefinitive 发表于 2025-3-23 08:59:25
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