標題: Titlebook: Atomistic Approaches in Modern Biology; From Quantum Chemist Markus Reiher Book 2007 Springer-Verlag Berlin Heidelberg 2007 biological mole [打印本頁] 作者: 使作嘔 時間: 2025-3-21 19:26
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作者: Cholesterol 時間: 2025-3-21 22:51 作者: Genome 時間: 2025-3-22 03:36
,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 [Fe] hydrogenases, are treated in more detail, with presentation and discussion of original data recentlyobtained in our laboratory.作者: 反抗者 時間: 2025-3-22 07:04 作者: 周興旺 時間: 2025-3-22 09:59
,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 paths 作者: Glossy 時間: 2025-3-22 14:08 作者: deciduous 時間: 2025-3-22 20:06 作者: 使饑餓 時間: 2025-3-22 21:18 作者: 身體萌芽 時間: 2025-3-23 01:27
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 prot作者: Definitive 時間: 2025-3-23 08:59 作者: Hemodialysis 時間: 2025-3-23 12:59
https://doi.org/10.1007/978-3-540-38085-6biological molecules; biology; chemistry; spectroscopy; theoretical chemistry作者: Esophagitis 時間: 2025-3-23 16:00 作者: aplomb 時間: 2025-3-23 20:23 作者: 令人悲傷 時間: 2025-3-24 02:03
Topics in Current Chemistryhttp://image.papertrans.cn/b/image/164807.jpg作者: 諂媚于人 時間: 2025-3-24 04:23
Atomistic Approaches in Modern Biology978-3-540-38085-6Series ISSN 0340-1022 Series E-ISSN 1436-5049 作者: dermatomyositis 時間: 2025-3-24 10:09
0340-1022 Overview: This series presents critical reviews of the present position and future trends in modern chemical research.Short and concise reports on chemistry, each written by world renowned experts.Still valid a978-3-642-07240-6978-3-540-38085-6Series ISSN 0340-1022 Series E-ISSN 1436-5049 作者: Ingest 時間: 2025-3-24 13:39 作者: 責怪 時間: 2025-3-24 17:25 作者: blithe 時間: 2025-3-24 22:38
First-Principles Approach to Vibrational Spectroscopy of Biomolecules, systems of reasonable size with sufficient computational accuracy. This is why the focus ofthis work is on the selective first-principles calculation of vibrational spectra of biomolecules obtainedby special techniques such as difference IR and Raman, Vibrational Circular Dichroism, Raman Optical A作者: 摻假 時間: 2025-3-25 02:06
,Car–Parrinello Molecular Dynamics Simulations and Biological Systems,ndard method for obtainingthe electronic structure during a?CPMD simulation. QM/MM approaches, which combine the CPMD methodfor a?core region with a?classical description of its environment, are also reviewed. These schemesprovide a?more reliable description of biological systems, whose properties a作者: intricacy 時間: 2025-3-25 06:10
,PcrA Helicase, a?Molecular Motor Studied from the Electronic to the Functional Level, simulationsare used to study the catalytic ATP hydrolysis event and its coupling to protein conformational changes.Molecular dynamics simulations then provide a?means of studying overall PcrA function on a?nanosecondtime scale. Finally, to reach physiologically relevant time scales, i.e., milliseco作者: 單色 時間: 2025-3-25 07:41 作者: 頭腦冷靜 時間: 2025-3-25 12:24
,Auswertung zu den Standard-Führungsstilen,ndard method for obtainingthe electronic structure during a?CPMD simulation. QM/MM approaches, which combine the CPMD methodfor a?core region with a?classical description of its environment, are also reviewed. These schemesprovide a?more reliable description of biological systems, whose properties a作者: 偶像 時間: 2025-3-25 19:52 作者: maintenance 時間: 2025-3-25 20:55
,Quantum Chemical Investigations of Reaction Paths of Metalloenzymes and Biomimetic Models – The Hydar, 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 paths 作者: 木質(zhì) 時間: 2025-3-26 02:54 作者: 正面 時間: 2025-3-26 05:30 作者: 放氣 時間: 2025-3-26 12:09 作者: 陪審團 時間: 2025-3-26 14:56
Transition Path Sampling Simulations of Biological Systems, 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 prot作者: 挖掘 時間: 2025-3-26 20:27
,PcrA Helicase, a?Molecular Motor Studied from the Electronic to the Functional Level,sport, energy metabolism, and DNA processing. Theiroperation cycle spans a?wide range of length and time scales, from the localized and fast chemicalreaction in the catalytic site(s) to the large scale and much slower conformational motions involved inthe motors‘ physiological function. From a?compu作者: Deceit 時間: 2025-3-26 21:28
9樓作者: 慢慢流出 時間: 2025-3-27 04:08
9樓作者: 廣口瓶 時間: 2025-3-27 05:16
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