標(biāo)題: Titlebook: Electron Density and Chemical Bonding II; Theoretical Charge D Dietmar Stalke Book 2012 Springer-Verlag Berlin Heidelberg 2012 [打印本頁] 作者: CAP 時間: 2025-3-21 16:29
書目名稱Electron Density and Chemical Bonding II影響因子(影響力)
書目名稱Electron Density and Chemical Bonding II影響因子(影響力)學(xué)科排名
書目名稱Electron Density and Chemical Bonding II網(wǎng)絡(luò)公開度
書目名稱Electron Density and Chemical Bonding II網(wǎng)絡(luò)公開度學(xué)科排名
書目名稱Electron Density and Chemical Bonding II被引頻次
書目名稱Electron Density and Chemical Bonding II被引頻次學(xué)科排名
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書目名稱Electron Density and Chemical Bonding II年度引用學(xué)科排名
書目名稱Electron Density and Chemical Bonding II讀者反饋
書目名稱Electron Density and Chemical Bonding II讀者反饋學(xué)科排名
作者: 不在灌木叢中 時間: 2025-3-21 20:23
Reliable Measurements of Dipole Moments from Single-Crystal Diffraction Data and Assessment of an Ifraction data. Recommendations for practical modeling choices are given when using the Hansen/Coppens multipole model. Multipole-model results, including those from invariom refinement, are found to be less accurate than results from a basis-set description. The question whether a molecular dipole-m作者: 多余 時間: 2025-3-22 00:25
Challenging Problems in Charge Density Determination: Polar Bonds and Influence of the Environment,ses EDs measured at hand of crystals of a given ligand to predict its pharmaceutical properties. This comprises for example the questions if the ligand fits into the active center of an enzyme and how strong it binds to this active side. This widely used approximation strongly rely on the assumption作者: delegate 時間: 2025-3-22 06:19 作者: 名義上 時間: 2025-3-22 11:43 作者: 現(xiàn)暈光 時間: 2025-3-22 14:26
The Source Function Descriptor as a Tool to Extract Chemical Information from Theoretical and Experscriptor is defined and what it physically represents, the various forms through which the SF may be analyzed are presented in some detail. The relationships between atomic SF contributions and chemical bond nature are analyzed in some prototypical cases, and the capability of the SF to neatly revea作者: 現(xiàn)暈光 時間: 2025-3-22 20:45
Book 2012easurements of Dipole Moments from Single-Crystal Diffraction Data and Assessment of an In-Crystal Enhancement.-.B. Engels, Th. C. Schmidt, C. Gatti, T. Schirmeister, R.F. Fink: Challenging Problems in Charge Density Determination: Polar Bonds and Influence of the Environment.-.S. Fux, M. Reiher: El作者: 準(zhǔn)則 時間: 2025-3-23 00:07 作者: 心痛 時間: 2025-3-23 03:14 作者: cardiac-arrest 時間: 2025-3-23 06:58 作者: 改革運(yùn)動 時間: 2025-3-23 10:38 作者: inquisitive 時間: 2025-3-23 17:35
0081-5993 : The Source Function Descriptor as a Tool to Extract Chemical Information from Theoretical and Experimental Electron Densities..978-3-642-44156-1978-3-642-30808-6Series ISSN 0081-5993 Series E-ISSN 1616-8550 作者: ALT 時間: 2025-3-23 19:45 作者: Physiatrist 時間: 2025-3-24 00:08
https://doi.org/10.1007/978-3-030-68940-7 covalently bonded cathepsin B–E64c complex. It clearly comes out that the reaction only takes place since the ED of the ligand is influenced in a way which is not found in the respective crystals. Nevertheless, the review also shows that the above mentioned approximation holds for AMCHA which serve作者: grounded 時間: 2025-3-24 02:36
Andriy Luntovskyy,Dietbert Gütterresidual density. The RDA cannot give a proof for the correctness of a model, but it can disprove the expected matching with Gaussian residuals between model and data. Applications of the RDA to electron reconstructions from Multipole Models and from an application of the Maximum Entropy Method are 作者: 格子架 時間: 2025-3-24 06:46 作者: ICLE 時間: 2025-3-24 13:15
New Directions in Pseudoatom-Based X-Ray Charge Density Analysis,e chemical transferability of stockholder pseudoatoms is analyzed through small-molecule model studies. A protocol to build a stockholder-atom library and the feasibility of simple data-refinement strategies using the databank radial functions is also discussed.作者: RAGE 時間: 2025-3-24 16:02
Challenging Problems in Charge Density Determination: Polar Bonds and Influence of the Environment, covalently bonded cathepsin B–E64c complex. It clearly comes out that the reaction only takes place since the ED of the ligand is influenced in a way which is not found in the respective crystals. Nevertheless, the review also shows that the above mentioned approximation holds for AMCHA which serve作者: Blood-Clot 時間: 2025-3-24 20:05 作者: CHECK 時間: 2025-3-25 02:14
The Source Function Descriptor as a Tool to Extract Chemical Information from Theoretical and Exper metal–ligand interactions in the organometallic complexes. Comparison with the insight obtained from other bond topological descriptors is given, emphasizing the special role the SF has of being directly derivable from experimental electron density distributions and to so provide an ideal tool to c作者: Graduated 時間: 2025-3-25 04:08 作者: paragon 時間: 2025-3-25 07:29 作者: FOIL 時間: 2025-3-25 14:55 作者: Factorable 時間: 2025-3-25 16:41
Electron Density in Quantum Theory,oximate relativistic Hamiltonians. For this purpose, we give an overview on different approximations to the fully relativistic many-electron Hamiltonian. In addition, we present new results, considering correlation effects on the electron density of a transition metal complex.作者: Laconic 時間: 2025-3-26 00:02 作者: 開頭 時間: 2025-3-26 02:58 作者: airborne 時間: 2025-3-26 04:25 作者: 遺傳 時間: 2025-3-26 10:18
https://doi.org/10.1007/978-94-011-1322-9oximate relativistic Hamiltonians. For this purpose, we give an overview on different approximations to the fully relativistic many-electron Hamiltonian. In addition, we present new results, considering correlation effects on the electron density of a transition metal complex.作者: Torrid 時間: 2025-3-26 14:15 作者: Audiometry 時間: 2025-3-26 18:04
Highs and Lows of European Integrationscriptor is defined and what it physically represents, the various forms through which the SF may be analyzed are presented in some detail. The relationships between atomic SF contributions and chemical bond nature are analyzed in some prototypical cases, and the capability of the SF to neatly revea作者: 辮子帶來幫助 時間: 2025-3-26 21:35
Dietmar StalkeThis series presents critical reviews of the present position and future trends in modern chemical research concerned with chemical structure and bonding.Short and concise reports, each written by the作者: osteoclasts 時間: 2025-3-27 01:10
Structure and Bondinghttp://image.papertrans.cn/e/image/306101.jpg作者: 群居男女 時間: 2025-3-27 08:17 作者: IDEAS 時間: 2025-3-27 12:12
Gourav Goel,S. N. Sachdeva Mitglieder einer Gesellschaft motiviert sind, hohe Summen in den milit?rischen Bereich zu investieren. Feindbilder müssen nicht mit der Realit?t übereinstimmen. Es ist gut bekannt, da? die Russen in den letzten 150 Jahren keinen Angriffskrieg begonnen haben. Nichtsdestoweniger beinhaltet das Feindbild der Russen die Eigenschaft ?aggressiv‘.作者: 概觀 時間: 2025-3-27 13:45 作者: nostrum 時間: 2025-3-27 19:08
Time-Specified Delivery of Chemotherapy by Implantable Programmable Pumps — Preliminary Data on 5-Fltotoxic therapy. The treatment goal for these metastatic tumors is palliation, not cure. As chemotherapy may not even prolong survival significantly, its application needs to be critically reviewed as to how it affects the patient’s quality of life.作者: 違反 時間: 2025-3-28 01:57 作者: 愛了嗎 時間: 2025-3-28 02:26
