| scholarly article | Q13442814 |
| P2093 | author name string | Michio Iwaoka | |
| Shinya Takemoto | |||
| Shuji Tomoda | |||
| P2860 | cites work | The development of versions 3 and 4 of the Cambridge Structural Database System | Q28090570 |
| P433 | issue | 35 | |
| P407 | language of work or name | English | Q1860 |
| P921 | main subject | molecular design | Q55213915 |
| statistics | Q12483 | ||
| protein design | Q410814 | ||
| P304 | page(s) | 10613-10620 | |
| P577 | publication date | 2002-09-01 | |
| P1433 | published in | Journal of the American Chemical Society | Q898902 |
| P1476 | title | Statistical and theoretical investigations on the directionality of nonbonded S...O interactions. Implications for molecular design and protein engineering | |
| P478 | volume | 124 |
| Q46623193 | 1,1,2,2-Tetracyanocyclopropane (TCCP) as supramolecular synthon |
| Q42386866 | 6-Methyl-sulfanyl-4H-pyrimido[1,6-a]pyrimidin-4-one. |
| Q58444892 | Ab initio and DFT studies of the interaction between carbonyl and thiocarbonyl groups: the role of S···O chalcogen bonds |
| Q86275126 | An ab initio study on the concerted interaction between chalcogen and pnicogen bonds |
| Q85412613 | An ab initio study on tunability of σ-hole interactions in XHS:PH2Y and XH2P:SHY complexes (X = F, Cl, Br; Y = H, OH, OCH3, CH3, C2H5, and NH2) |
| Q50467171 | An exploration of the ozone dimer potential energy surface. |
| Q36631481 | Boltzmann-type distribution of side-chain conformation in proteins |
| Q45239248 | Calmodulin methionine residues are targets for one-electron oxidation by hydroxyl radicals: formation of S[therefore]N three-electron bonded radical complexes |
| Q46339282 | Chalcogen bonding in synthesis, catalysis and design of materials. |
| Q51279519 | Chalcogen- and halogen-bonds involving SX2 (X = F, Cl, and Br) with formaldehyde. |
| Q46778677 | Chalcogen-bonded complexes. Selenium-bound adducts of NH3, H2O, PH3, and H2S with OCSe, SCSe, and CSe2. |
| Q47362081 | Characterization of chalcogen bonding interactions via an in-depth conceptual quantum chemical analysis |
| Q64028360 | Chiral Discrimination in Dimers of Diphosphines PH2PH2and PH2PHF |
| Q52730805 | Comparison of P···D (D = P,N) with other noncovalent bonds in molecular aggregates. |
| Q42041846 | Conformational change of the methionine 20 loop of Escherichia coli dihydrofolate reductase modulates pKa of the bound dihydrofolate |
| Q84705557 | Contributions of various noncovalent bonds to the interaction between an amide and S-containing molecules |
| Q33842089 | Crystal structure analysis of the polysialic acid specific O-acetyltransferase NeuO |
| Q35329906 | Design and mechanism of tetrahydrothiophene-based γ-aminobutyric acid aminotransferase inactivators |
| Q92883112 | Dispersion of Synthetic MoS2 Flakes and Their Spontaneous Adsorption on Single-Walled Carbon Nanotubes |
| Q86854343 | Does single-electron chalcogen bond exist? Some theoretical insights |
| Q53223808 | Dual functions of Lewis acid and base of Se in F2C=Se and their interplay in F 2CSe•••NH 3•••HX. |
| Q47901492 | Exploiting the σ-Hole Concept: An Infrared and Raman-Based Characterization of the S⋅⋅⋅O Chalcogen Bond between 2,2,4,4-Tetrafluoro-1,3-dithiethane and Dimethyl Ether. |
| Q91860937 | Halogen and Chalcogen Bond Energies Evaluated Using Electron Density Properties |
| Q91635036 | Hexacoordinated Tetrel-Bonded Complexes between TF4 (T=Si, Ge, Sn, Pb) and NCH: Competition between σ- and π-Holes |
| Q38018441 | Hypervalent nonbonded interactions of a divalent sulfur atom. Implications in protein architecture and the functions |
| Q48059470 | Improved Description of Sulfur Charge Anisotropy in OPLS Force Fields: Model Development and Parameterization |
| Q50893926 | Intermolecular carbon-carbon, nitrogen-nitrogen and oxygen-oxygen non-covalent bonding in dipolar molecules. |
| Q85335614 | Interplay between halogen and chalcogen bonding in the XCl∙∙∙OCS∙∙∙NH₃ (X = F, OH, NC, CN, and FCC) complex |
| Q46569227 | Interpretation of Spectroscopic Markers of Hydrogen Bonds |
| Q88615319 | Isothiourea-Catalysed Acylative Kinetic Resolution of Aryl-Alkenyl (sp2 vs. sp2 ) Substituted Secondary Alcohols |
| Q37649315 | Isothiourea-catalysed enantioselective pyrrolizine synthesis: synthetic and computational studies. |
| Q92815401 | Nature of the Interaction of Pyridines with OCS. A Theoretical Investigation |
| Q46295320 | Noble gas bond and the behaviour of XeO3 under pressure |
| Q33744327 | Non-bonding 1,5-S···O interactions govern chemo- and enantioselectivity in isothiourea-catalyzed annulations of benzazoles. |
| Q57566681 | Noncovalent Chalcogen Bonds and Disulfide Conformational Change in the Cystamine-Based Hybrid Perovskite [H3N(CH2)2SS(CH2)2NH3]PbIII4 |
| Q53171498 | Noncovalent Se···O Conformational Locks for Constructing High-Performing Optoelectronic Conjugated Polymers. |
| Q51424712 | Origin of selenium-gold interaction in F2CSe⋯AuY (Y = CN, F, Cl, Br, OH, and CH3): Synergistic effects. |
| Q27671833 | Peptide aldehyde inhibitors challenge the substrate specificity of the SARS-coronavirus main protease |
| Q41184018 | Possible roles of S···O and S···N interactions in the functions and evolution of phospholipase A2. |
| Q75209527 | Promise of advances in simulation methods for protein crystallography: implicit solvent models, time-averaging refinement, and quantum mechanical modeling |
| Q91667216 | Relative orientation of the carbonyl groups determines the nature of orbital interactions in carbonyl-carbonyl short contacts |
| Q48093639 | Reversible crystal-to-crystal chiral resolution: making/breaking non-bonding SO interactions. |
| Q33565240 | Single-crystal X-ray diffraction and NMR crystallography of a 1:1 cocrystal of dithianon and pyrimethanil |
| Q48044981 | Supramolecular Covalence in Bifurcated Chalcogen Bonding |
| Q58444977 | The Dominant Role of Chalcogen Bonding in the Crystal Packing of 2D/3D Aromatics |
| Q28077775 | The Halogen Bond |
| Q38539368 | The bright future of unconventional σ/π-hole interactions |
| Q24644707 | The characterization of mutant Bacillus subtilis adenylosuccinate lyases corresponding to severe human adenylosuccinate lyase deficiencies |
| Q46091880 | The influence of intramolecular sulfur-lone pair interactions on small-molecule drug design and receptor binding |
| Q50074356 | The role of the σ-holes in stability of non-bonded chalcogenidebenzene interactions: the ground and excited states |
| Q43256898 | Theoretical investigation on the effect of different nitrogen donors on intramolecular Se...N interactions |
| Q51049043 | Thiophene-benzoquinones: synthesis, crystal structures and preliminary coordination chemistry of derived anilate ligands. |
| Q44839104 | Three trithiadiazepines and a trithiatriazepine |
| Q86618097 | Tuning of chalcogen bonds by cation-π interactions: cooperative and diminutive effects |
| Q46760364 | Unusually short chalcogen bonds involving organoselenium: insights into the Se-N bond cleavage mechanism of the antioxidant ebselen and analogues |
Search more.