Applications of the Cambridge Structural Database in organic chemistry and crystal chemistry.
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RM1 Semiempirical Quantum Chemistry: Parameters for Trivalent Lanthanum, Cerium and PraseodymiumThe Cambridge Structural Database in retrospect and prospect.Investigation of a dichlorodioxomolybdenum(VI)-pyrazolylpyridine complex and a hybrid derivative as catalysts in olefin epoxidation.Engineering of a water-soluble plant cytochrome P450, CYP73A1, and NMR-based orientation of natural and alternate substrates in the active site.Data-driven high-throughput prediction of the 3-D structure of small molecules: review and progress.Applications of the Cambridge Structural Database in chemical education.Crystal structure of bis-[3-meth-oxy-17β-estra-1,3,5(10)-trien-17-yl] oxalate.Crystal structure of a layered coordination polymer based on a 4(4) net containing Cd(2+) ions and 1,5-bis-(pyridin-4-yl)pentane linkers.On the Primary Ionization Mechanism(s) in Matrix-Assisted Laser Desorption IonizationChemical aspects of the primary ionization mechanisms in matrix-assisted laser desorption ionization.The coordination chemistry of fluorine in fluorocarbons.Interplay between Structure and Charge as a Key to Allosteric Modulation of Human 20S Proteasome by the Basic Fragment of HIV-1 Tat ProteinStructural characterization and in vivo evaluation of β-Hairpin peptidomimetics as specific CXCR4 imaging agentsMolecular recognition in chemical and biological systems.Limitations and extensions of the lock-and-key principle: differences between gas state, solution and solid state structures.Chemical Partition of the Radiative Decay Rate of Luminescence of Europium Complexes.Structural Model Studies for the High-Valent Intermediate Q of Methane Monooxygenase from Broken-Symmetry Density Functional Calculations.New Tricks of the Trade for Crystal Structure Refinement.Quasi-1D chains of dinickel lantern complexes and their magnetic properties.Analysis of residue conformations in peptides in Cambridge structural database and protein-peptide structural complexes.A simple route to phosphamethine cyanines from S,N-heterocyclic carbenes.Stereoelectronic source of the anomalous stability of bis-peroxides.NMR and DFT investigations of structure of colchicine in various solvents including density functional theory calculations.3-Methylpiperidinium ionic liquids.Semiempirical quantum chemistry model for the lanthanides: RM1 (Recife Model 1) parameters for dysprosium, holmium and erbium.Conformational variability of benzamidinium-based inhibitorsStructure of 1,5-benzodiazepinones in the solid state and in solution: Effect of the fluorination in the six-membered ring.Poly[hexa-aqua-bis(μ(3)-naphthalene-2,6-dicarboxyl-ato)(μ(2)-naphthalene-2,6-dicarboxyl-ato)diholmium(III)].Theoretical description of hydrogen bonding in oxalic acid dimer and trimer based on the combined extended-transition-state energy decomposition analysis and natural orbitals for chemical valence (ETS-NOCV).The effect of pressure on the crystal structure of [Gd(PhCOO)3(DMF)]n to 3.7 GPa and the transition to a second phase at 5.0 GPa.Computational design of a Diels-Alderase from a thermophilic esterase: the importance of dynamics.Europium Luminescence: Electronic Densities and Superdelocalizabilities for a Unique Adjustment of Theoretical Intensity Parameters.The structures of two aldazines: [1,1'-(1E,1'E)-hydrazine-1,2-diylidenebis(methan-1-yl-1-ylidene)dinaphthalen-2-ol] (Lumogen) and 2,2'-(1E,1'E)-hydrazine-1,2-diylidenebis(methan-1-yl-1-ylidene)diphenol (salicylaldazine) in the solid state and in solEutectics as improved pharmaceutical materials: design, properties and characterization.A trihydroxy tin group that resists oligomerization in the trinuclear nickel cluster [Ni3(mu-P,P'-PPh2CH2PPh2)3(mu3-L)- (mu3-Sn(OH)3)].Self-assembly structures of 1H-indazoles in the solution and solid phases: a vibrational (IR, FIR, Raman, and VCD) spectroscopy and computational study.Piezochromism in nickel salicylaldoximato complexes: tuning crystal-field splitting with high pressure.Synthesis, a case of isostructural packing, and antimicrobial activity of silver(I)quinoxaline nitrate, silver(I)(2,5-dimethylpyrazine) nitrate and two related silver aminopyridine compounds.Static and dynamic properties of 1,1'-bi-2-naphthol and its conjugated acids and bases.Distinctive EPR signals provide an understanding of the affinity of bis-(3-hydroxy-4-pyridinonato) copper(II) complexes for hydrophobic environments.
P2860
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P2860
Applications of the Cambridge Structural Database in organic chemistry and crystal chemistry.
description
2002 nî lūn-bûn
@nan
2002 թուականի Մայիսին հրատարակուած գիտական յօդուած
@hyw
2002 թվականի մայիսին հրատարակված գիտական հոդված
@hy
2002年の論文
@ja
2002年学术文章
@wuu
2002年学术文章
@zh-cn
2002年学术文章
@zh-hans
2002年学术文章
@zh-my
2002年学术文章
@zh-sg
2002年學術文章
@yue
name
Applications of the Cambridge ...... emistry and crystal chemistry.
@ast
Applications of the Cambridge ...... emistry and crystal chemistry.
@en
Applications of the Cambridge ...... emistry and crystal chemistry.
@nl
type
label
Applications of the Cambridge ...... emistry and crystal chemistry.
@ast
Applications of the Cambridge ...... emistry and crystal chemistry.
@en
Applications of the Cambridge ...... emistry and crystal chemistry.
@nl
prefLabel
Applications of the Cambridge ...... emistry and crystal chemistry.
@ast
Applications of the Cambridge ...... emistry and crystal chemistry.
@en
Applications of the Cambridge ...... emistry and crystal chemistry.
@nl
P1476
Applications of the Cambridge ...... emistry and crystal chemistry.
@en
P2093
Frank H Allen
W D Samuel Motherwell
P304
P356
10.1107/S0108768102004895
P433
P577
2002-05-29T00:00:00Z