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年访问量

166

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  • 外部: 166

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总访问量

705

  • 内部: 48

  • 外部: 657

  • 国内: 611

  • 国外: 94

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1. The ONIOM Method and Its Applications [1067]
2. Computational Organic Chemistry: Bridging Theory and Experiment in.. [489]
3. Enantioselective Hydrogenation of Tetrasubstituted α,β-Unsaturat.. [218]
4. Asymmetric Total Synthesis of Cerorubenic Acid-III [198]
5. Ferrocenyl chiral bisphosphorus ligands for highly enantioselectiv.. [195]
6. Enantioselective Palladium-Catalyzed Decarboxylative Allylation of.. [176]
7. Enantioselective Rhodium-Catalyzed Cycloisomerization of 1,6-Allen.. [162]
8. Enzyme-Inspired Chiral Secondary-Phosphine-Oxide Ligand with Dual .. [161]
9. Rhodium-catalyzed asymmetric hydrogenation of beta-cyanocinnamic e.. [160]
10. Development of a novel secondary phosphine oxide-ruthenium(II) cat.. [160]
11. A Computational Study of Asymmetric Hydrogenation of 2-Phenyl Acry.. [150]
12. Design and Application of Hybrid Phosphorus Ligands for Enantiosel.. [149]
13. Iridium-Catalyzed Asymmetric Hydrogenation of Ketones with Accessi.. [145]
14. Novel Molecular Doping Mechanism for n-Doping of SnO2 via Tripheny.. [139]
15. Nickel-catalyzed asymmetric hydrogenation of beta-acylamino nitroo.. [138]
16. Bronsted-Acid-Promoted Rh-Catalyzed Asymmetric Hydrogenation of N-.. [135]
17. Hydrogenation of Aldehydes Catalyzed by an Available Ruthenium Com.. [131]
18. Multiscale Simulations on Spectral Tuning and the Photoisomerizati.. [124]
19. 镍催化的β-酰胺基硝基烯烃不对称氢化反应的机理研究 [119]
20. Kinetic Resolution of Alkylidene Norcamphors via a Ligand-Controll.. [117]
21. beta-Substituted Alkenyl Heteroarenes as Dipolarophiles in the Cu(.. [102]
22. Ligand-Controlled Reactivity, Selectivity, and Mechanism of Cation.. [99]
23. Colorimetric Calcium Probe with Comparison to an Ion-Selective Opt.. [94]
24. Exploiting the trifluoroethyl group as a precatalyst ligand in nic.. [93]
25. Asymmetric synthesis of quaternary α-Trifluoromethyl α-Amino aci.. [92]
26. A Combined DFT/IM-MS Study on the Reaction Mechanism of Cationic R.. [90]
27. Organocatalytic atroposelective synthesis of axially chiral styren.. [88]
28. Guest-Induced Folding and Self-Assembly of Conformationally Adapti.. [88]
29. Unusual KIE and dynamics effects in the Fe-catalyzed hetero-Diels-.. [88]
30. Alternative Mechanistic Strategy for Enzyme Catalysis in a Ni-Depe.. [87]
31. Multiscale Quantum Refinement Approaches for Metalloproteins [85]
32. N-Bridged Pincer Iridium Complexes for Highly Efficient Alkane Deh.. [84]
33. Enantioselective palladium-catalyzed diboration of 1,1-disubstitut.. [83]
34. Mechanism of Ni-NHC Catalyzed Hydrogenolysis of Aryl Ethers: Roles.. [80]
35. Highly Regio- and Stereoselective Hydrosilylation of Internal Thio.. [79]
36. Ru-Catalyzed Geminal Hydroboration of Silyl Alkynes via a New gem-.. [76]
37. Catalytic asymmetric trifluoromethylthiolation of carbonyl compoun.. [74]
38. Efficient syntheses of (-)-crinine and (-)-aspidospermidine, and t.. [74]
39. Ru-Catalyzed Migratory Geminal Semihydrogenation of Internal Alkyn.. [74]
40. Computational Insights into the Reaction Mechanisms of Nickel-Cata.. [73]
41. Asymmetric Total Synthesis of Phomarol [73]
42. Quantum Tunneling in Reactions Modulated by External Electric Fiel.. [70]
43. Elucidating the Key Role of Phosphine-Sulfonate Ligands in Palladi.. [69]
44. New Mechanistic Insights on the Selectivity of Transition-Metal-Ca.. [68]
45. New Tricks for an Old Dog: Grubbs Catalysts Enable Efficient Hydro.. [67]
46. Practical and Asymmetric Reductive Coupling of Isoquinolines Templ.. [62]
47. A Missing Piece of the Mechanism in Metal-Catalyzed Hydrogenation:.. [59]
48. Dearomative indole [5+2] cycloaddition reactions: Stereoselective .. [59]
49. Mechanistic insights into asymmetric reductive coupling of isoquin.. [58]
50. Reaction Mechanism of Cu(I)-Mediated Reductive CO2 Coupling for th.. [58]
51. New Insights and Predictions into Complex Homogeneous Reactions En.. [57]
52. Structure-property relationships of photofunctional diiridium(II) .. [57]
53. Water as a direct proton source for asymmetric hydroarylation cata.. [55]
54. Theoretical Study on the UVR8 Photoreceptor: Sensing Ultraviolet-B.. [54]
55. A Mechanistic Study of the Cobalt(I)-Catalyzed Amination of Aryl H.. [53]
56. Computational Prediction of Excited-State Carbon Tunneling in the .. [52]
57. Development of a novel secondary phosphine oxide-ruthenium(II) cat.. [51]
58. Rhodium(I) Carbene-Promoted Enantioselective C−H Functionalizatio.. [48]
59. Intramolecular [3 + 2] annulation of allenylsilane-enes: Direct sy.. [44]
60. Regiospecific and Enantioselective Arylvinylcarbene Insertion of a.. [43]
61. Ir-Catalyzed Asymmetric Hydrogenation of Unprotected Indoles: Scop.. [43]
62. Breaking Conventional Site Selectivity in C-H Bond Activation: Sel.. [40]
63. Electron-rich benzofulvenes as effective dipolarophiles in copper(.. [34]
64. Copper-catalyzed asymmetric 1,3-dipolar cycloaddition of azomethin.. [33]
65. A Computational Study on the Reaction Mechanism of Stereocontrolle.. [30]
66. 钴(-I)和铁(-I)催化的烯烃和酮的催化氢化:基于密度泛函理论的机理研究 [25]
67. Asymmetric Synthesis of Vicinal Tetrasubstituted Diamines via Redu.. [16]
68. Accelerating reliable multiscale quantum refinement of protein–dr.. [8]
69. A versatile cobalt catalyst for highly enantioselective hydrogenat.. [4]
70. Asymmetric Cyclopropanation of Primary N-Vinylamides via Ca.. [1]
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