Predicting hydrogen-bond strengths from acid-base molecular properties. The pK(a) slide rule: toward the solution of a long-lasting problem.
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Recognition of RNA duplexes by chemically modified triplex-forming oligonucleotidesCryoprotectant Toxicity: Facts, Issues, and QuestionsQuantitative dissection of hydrogen bond-mediated proton transfer in the ketosteroid isomerase active siteMutations in BIN1 associated with centronuclear myopathy disrupt membrane remodeling by affecting protein density and oligomerizationPeptide-catalyzed kinetic resolution of formamides and thioformamides as an entry to nonracemic amines.A robust binary supramolecular organic framework (SOF) with high CO2 adsorption and selectivity.The structural basis of urea-induced protein unfolding in β-cateninHydrogen bridges of polycyclic aromatic systems with O-H···O bonds--a gas-phase vs. solid-state Car-Parrinello study.Accurate determination of the binding energy of the formic acid dimer: the importance of geometry relaxation.Aqueous solvation of polyalanine α-helices with specific water molecules and with the CPCM and SM5.2 aqueous continuum models using density functional theoryEnantioselective synthesis of atropisomeric benzamides through peptide-catalyzed bromination.Structural studies of β-turn-containing peptide catalysts for atroposelective quinazolinone bromination.Entropic factors provide unusual reactivity and selectivity in epoxide-opening reactions promoted by water.n→π* Interactions Are Competitive with Hydrogen Bonds.Enantioselective synthesis of 3-arylquinazolin-4(3H)-ones via peptide-catalyzed atroposelective bromination.Diversity of Secondary Structure in Catalytic Peptides with β-Turn-Biased SequencesBeyond click chemistry - supramolecular interactions of 1,2,3-triazoles.1H-NMR as a structural and analytical tool of intra- and intermolecular hydrogen bonds of phenol-containing natural products and model compounds.Binding Mode of Acetylated Histones to Bromodomains: Variations on a Common Motif.Locking the Coplanar Conformation of π-Conjugated Molecules and Macromolecules Using Dynamic Noncovalent Bonds.Using Voltammetry to Measure the Relative Hydrogen-Bonding Strengths of Pyridine and Its Derivatives in Acetonitrile.Optical sensing of anions via supramolecular recognition with biimidazole complexes.NMR and IR Investigations of Strong Intramolecular Hydrogen Bonds.Porous Organic Molecular Frameworks with Extrinsic Porosity: A Platform for Carbon Storage and Separation.Resonance-Assisted Hydrogen Bonding as a Driving Force in Synthesis and a Synthon in the Design of Materials.Short Carboxylic Acid-Carboxylate Hydrogen Bonds Can Have Fully Localized Protons.Hydrogen Atomic Positions of O-H···O Hydrogen Bonds in Solution and in the Solid State: The Synergy of Quantum Chemical Calculations with ¹H-NMR Chemical Shifts and X-ray Diffraction Methods.Structures and physicochemical properties of vortioxetine salts.Interference of H-bonding and substituent effects in nitro- and hydroxy-substituted salicylaldehydes.Rapid quantification of the activating effects of hydrogen-bonding catalysts with a colorimetric sensor.Driving force dependence of rates for nonadiabatic proton and proton-coupled electron transfer: conditions for inverted region behavior.Quantification of electrophilic activation by hydrogen-bonding organocatalysts.Synergistic Ion-Binding Catalysis Demonstrated via an Enantioselective, Catalytic [2,3]-Wittig Rearrangement.Effects of the protonation state in the interaction of an HIV-1 reverse transcriptase (RT) amino acid, Lys101, and a non nucleoside RT inhibitor, GW420867X.Atom interaction propensities of oxygenated chemical functions in crystal packings.Pseudo-cyclic structures of mono- and di-azaderivatives of malondialdehydes. Synthesis and conformational disentanglement by computational analyses.Origin of the superior performance of (thio)squaramides over (thio)ureas in organocatalysis.Intermolecular hydrogen bond energies in crystals evaluated using electron density properties: DFT computations with periodic boundary conditions.Reactivity, photolability, and computational studies of the ruthenium nitrosyl complex with a substituted cyclam fac-[Ru(NO)Cl2(κ3N4,N8,N11(1-carboxypropyl)cyclam)]Cl·H2O.Dinuclear Complexes Formed by Hydrogen Bonds: Synthesis, Structure and Magnetic and Electrochemical Properties.
P2860
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P2860
Predicting hydrogen-bond strengths from acid-base molecular properties. The pK(a) slide rule: toward the solution of a long-lasting problem.
description
2009 nî lūn-bûn
@nan
2009 թուականի Յունուարին հրատարակուած գիտական յօդուած
@hyw
2009 թվականի հունվարին հրատարակված գիտական հոդված
@hy
2009年の論文
@ja
2009年論文
@yue
2009年論文
@zh-hant
2009年論文
@zh-hk
2009年論文
@zh-mo
2009年論文
@zh-tw
2009年论文
@wuu
name
Predicting hydrogen-bond stren ...... ion of a long-lasting problem.
@ast
Predicting hydrogen-bond stren ...... ion of a long-lasting problem.
@en
type
label
Predicting hydrogen-bond stren ...... ion of a long-lasting problem.
@ast
Predicting hydrogen-bond stren ...... ion of a long-lasting problem.
@en
prefLabel
Predicting hydrogen-bond stren ...... ion of a long-lasting problem.
@ast
Predicting hydrogen-bond stren ...... ion of a long-lasting problem.
@en
P2093
P356
P1476
Predicting hydrogen-bond stren ...... ion of a long-lasting problem.
@en
P2093
Gastone Gilli
Loretta Pretto
Paola Gilli
P356
10.1021/AR800001K
P407
P577
2009-01-01T00:00:00Z