相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Tetrel and Pnictogen Bonds Complement Hydrogen and Halogen Bonds in Framing the Interactional Landscape of Barbituric Acids
Vijith Kumar et al.
CRYSTAL GROWTH & DESIGN (2021)
Cooperative Effects between Hydrogen Bonds and C=O•••S Interactions in the Crystal Structures of Sulfoxides
Jorge Echeverria
CRYSTAL GROWTH & DESIGN (2021)
The Neglected Nuclei
Peter Politzer et al.
MOLECULES (2021)
Conformation of protonated guanine nucleotides via infrared multiphoton dissociation spectroscopy: Observation of rotamers in the anti-conformation
Hiroya Asami et al.
CHEMICAL PHYSICS LETTERS (2020)
Electric properties of hydrated uracil: From micro- to macrohydration
Tomas Hrivnak et al.
JOURNAL OF MOLECULAR LIQUIDS (2019)
Nucleoside Analogues as Antibacterial Agents
Jessica M. Thomson et al.
FRONTIERS IN MICROBIOLOGY (2019)
Interplay of Ring Puckering and Hydrogen Bonding in Deoxyribonucleosides
Siying Lyu et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2019)
Investigation of 5'-Norcarbocyclic Nucleoside Analogues as Antiprotozoal and Antibacterial Agents
Anastasia L. Khandazhinskaya et al.
MOLECULES (2019)
Understanding biochemistry: structure and function of nucleic acids
Steve Minchin et al.
UNDERSTANDING BIOCHEMISTRY 5 (2019)
Ionization and Electron Attachment for Nucleobases in Water
Yan Zhang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2019)
Ionization and fragmentation of uracil upon microhydrationn
Abderrahmane Semmeq et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2019)
Hydrogen Bonds: Simple after All?
Daniel Herschlag et al.
BIOCHEMISTRY (2018)
Synthesis of α-Branched Acyclic Nucleoside Phosphonates as Potential Inhibitors of Bacterial Adenylate Cyclases
Jan Frydrych et al.
CHEMMEDCHEM (2018)
Nature of bonding and cooperativity in linear DMSO clusters: A DR AIM and NCI analysis
Natarajan Sathiyamoorthy Venkataramanan et al.
JOURNAL OF MOLECULAR GRAPHICS & MODELLING (2018)
Nucleobases and corresponding nucleosides display potent antiviral activities against dengue virus possibly through viral lethal mutagenesis
Li Qiu et al.
PLOS NEGLECTED TROPICAL DISEASES (2018)
Effect of Solvation on the Ionization of Guanine Nucleotide: A Hybrid QM/EFP Study
Rahul Chakraborty et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2017)
Intermolecular interaction in nucleobases and dimethyl sulfoxide/water molecules: A DFT, NBO, AIM and NCI analysis
Natarajan Sathiyamoorthy Venkataramanan et al.
JOURNAL OF MOLECULAR GRAPHICS & MODELLING (2017)
Theoretical Investigation of the Binding of Nucleobases to Cucurbiturils by Dispersion Corrected DFT Approaches
Natarajan Sathiyamoorthy Venkataramanan et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2017)
σ-Hole Interactions: Perspectives and Misconceptions
Peter Politzer et al.
CRYSTALS (2017)
The expanding world of DNA and RNA
Tingjian Chen et al.
CURRENT OPINION IN CHEMICAL BIOLOGY (2016)
Cooperativity of intermolecular hydrogen bonds in microsolvated DMSO and DMF clusters: a DFT, AIM, and NCI analysis
Natarajan Sathiyamoorthy Venkataramanan
JOURNAL OF MOLECULAR MODELING (2016)
Microhydration of Deprotonated Nucleobases
Henryk Wincel
JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY (2016)
Microhydration effects on the structures and electrophilic properties of cytidine
Peng Shao et al.
RSC ADVANCES (2016)
Gas-Phase Conformations and Energetics of Protonated 2′-Deoxyadenosine and Adenosine: IRMPD Action Spectroscopy and Theoretical Studies
R. R. Wu et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2015)
Encapsulation of sulfur, oxygen, and nitrogen mustards by cucurbiturils: a DFT study
Natarajan Sathiyamoorthy Venkataramanan et al.
JOURNAL OF INCLUSION PHENOMENA AND MACROCYCLIC CHEMISTRY (2015)
Intermolecular CH•••O/N H-bonds in the biologically important pairs of natural nucleobases: a thorough quantum-chemical study
Ol'ha O. Brovarets' et al.
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS (2014)
Gas-Phase Conformations and Energetics of Protonated 2′-Deoxyguanosine and Guanosine: IRMPD Action Spectroscopy and Theoretical Studies
R. R. Wu et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2014)
Energy-Dependent UV Photodissociation of Gas-Phase Adenosine Monophosphate Nucleotide Ions: The Role of a Single Solvent Molecule
Aleksandar R. Milosavljevic et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2014)
Antithyroid Drugs and Their Analogues: Synthesis, Structure, and Mechanism of Action
Debasish Manna et al.
ACCOUNTS OF CHEMICAL RESEARCH (2013)
Stacked base-pair structures of adenine nucleosides stabilized by the formation of hydrogen-bonding network involving the two sugar groups
Hiroya Asami et al.
CHEMICAL PHYSICS (2013)
Structures, electrophilic properties, and hydrogen bonds of cytidine, uridine, and their radical anions: Microhydration effects
Peng Shao et al.
JOURNAL OF CHEMICAL PHYSICS (2013)
Performance of M06, M06-2X, and M06-HF Density Functionals for Conformationally Flexible Anionic Clusters: M06 Functionals Perform Better than B3LYP for a Model System with Dispersion and Ionic Hydrogen-Bonding Interactions
Martin Walker et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2013)
A theoretical study on 2′-deoxyguanosine and its mono-hydration: Intermolecular hydrogen bonding weakening induces the fluorescence strengthening
Yufang Liu et al.
CHEMICAL PHYSICS LETTERS (2012)
Multiwfn: A multifunctional wavefunction analyzer
Tian Lu et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2012)
Controlling Glycosyl Bond Conformation of Guanine Nucleosides: Stabilization of the anti Conformer in 5′-O-Ethylguanosine
Hiroya Asami et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2012)
Intrinsic Contribution of the 2′-Hydroxyl to RNA Conformational Heterogeneity
Elizabeth J. Denning et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2012)
Ionization of Purine Tautomers in Nucleobases, Nucleosides, and Nucleotides: From the Gas Phase to the Aqueous Environment
Eva Pluharova et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2011)
Quantitative analysis of molecular surfaces: areas, volumes, electrostatic potentials and average local ionization energies
Felipe A. Bulat et al.
JOURNAL OF MOLECULAR MODELING (2010)
Vertical Ionization Potentials of Nucleobases in a Fully Solvated DNA Environment
Emilie Cauet et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2010)
Hydrogen bonding and structure of uracil-water and thymine-water complexes
Juan Carlos Lopez et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
A comparison of DNA and RNA quadruplex structures and stabilities
Astrid Joachimi et al.
BIOORGANIC & MEDICINAL CHEMISTRY (2009)
IR-UV Double Resonance Spectroscopy of the Hydrated Clusters of Guanosine and 9-Methylguanine: Evidence for Hydration Structures Involving the Sugar Group
Hiroyuki Saigusa et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2009)
Microhydration of Protonated Nucleic Acid Bases and Protonated Nucleosides in the Gas Phase
Henryk Wincel
JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY (2009)
Hydration structures of 2′-deoxyguanosine studied by IR-UV double resonance spectroscopy: comparison with guanosine
Hiroya Asami et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
An appraisal of Poincare-Hopf relation and application to topography of molecular electrostatic potentials
D. Roy et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
A theoretical study on tautomerization processes of dehydrated and monohydrated cytosine
Donatella Mazzuea et al.
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM (2007)
Hydration and stability of nucleic acid bases and base pairs
Martin Kabelac et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)
A new local density functional for main-group thermochemistry, transition metal bonding, thermochemical kinetics, and noncovalent interactions
Yan Zhao et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Binding of transition metal complexes to guanine and guanine-cytosine: hydrogen bonding and covalent effects
A Robertazzi et al.
JOURNAL OF BIOLOGICAL INORGANIC CHEMISTRY (2005)
IR-UV double resonance spectroscopy of guanine-H2O clusters
B Crews et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2005)
Conformers of guanosines and their vibrations in the electronic ground and excited states, as revealed by double-resonance spectroscopy and ab initio calculations
E Nir et al.
CHEMPHYSCHEM (2004)
Nucleoside analogues and nucleobases in cancer treatment
CM Galmarini et al.
LANCET ONCOLOGY (2002)
Chemistry with ADF
G te Velde et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2001)
REMPI spectroscopy of laser desorbed guanosines
E Nir et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)