Works about TAUTOMERISM

Results: 1030

Glycans and Chirality: Stereoselectivity at the Core of DC‐SIGN's Recognition. A Novel View of the Optimum Minimal Ligand Epitope.

Published in:

Chemistry - A European Journal, 2025, v. 31, n. 37, p. 1, doi. 10.1002/chem.202501420

By:

Martínez, J. Daniel;
Núñez‐Franco, Reyes;
Valverde, Pablo;
Delgado, Sandra;
Ardá, Ana;
Jiménez‐Barbero, Jesús;
Jiménez‐Oses, Gonzalo;
Cañada, F. Javier

Publication type:

Article

4-(8-Propyl-2,4-dithioxo-1,3-diazaspiro[4.5]decan-3-yl)spiro[1,5-dihydro-1,5-benzodiazepine-2,3′-indoline]-2′-one).

Published in:

Molbank, 2025, v. 2025, n. 2, p. M2011, doi. 10.3390/M2011

By:

Stoitsov, Dimitar;
Marinov, Marin;
Penchev, Plamen;
Stoyanov, Neyko

Publication type:

Article

Preparation, Characterization, and Properties of 7-Nitrotetrazolo[1,5- f ]furazano[4,5- b ]pyridine 1-Oxide.

Published in:

Journal of Energetic Materials, 2005, v. 23, n. 2, p. 99, doi. 10.1080/07370650590936424

By:

Huynh, My Hang V.;
Hiskey, Michael A.;
Chavez, David E.;
Gilardi, Richard D.

Publication type:

Article

Structural modifications of dicationic acetylcholinesterase reactivators studied under ion-pairing mechanism in reversed-phase liquid chromatography.

Published in:

Journal of Separation Science, 2014, v. 37, n. 21, p. 3024, doi. 10.1002/jssc.201400390

By:

Radulescu, Medeea;
Kuca, Kamil;
Musilek, Kamil;
David, Victor

Publication type:

Article

Liquid-Filled Valence Tautomeric Microcapsules: A Solid Material with Solution-Like Behavior.

Published in:

Advanced Functional Materials, 2015, p. 4129, doi. 10.1002/adfm.201501166

By:

Hernando, Jordi;
Vázquez-Mera, Nuria Alexandra;
Roscini, Claudio;
Ruiz-Molina, Daniel

Publication type:

Article

Organic Electronics: Stable Alignment of Tautomers at Room Temperature in Porphyrin 2D Layers (Adv. Funct. Mater. 7/2014).

Published in:

Advanced Functional Materials, 2014, v. 24, n. 7, p. 957, doi. 10.1002/adfm.201470043

By:

Bussetti, Gianlorenzo;
Campione, Marcello;
Riva, Michele;
Picone, Andrea;
Raimondo, Luisa;
Ferraro, Lorenzo;
Hogan, Conor;
Palummo, Maurizia;
Brambilla, Alberto;
Finazzi, Marco;
Duò, Lamberto;
Sassella, Adele;
Ciccacci, Franco

Publication type:

Article

Stable Alignment of Tautomers at Room Temperature in Porphyrin 2D Layers.

Published in:

Advanced Functional Materials, 2014, v. 24, n. 7, p. 958, doi. 10.1002/adfm.201301892

By:

Bussetti, Gianlorenzo;
Campione, Marcello;
Riva, Michele;
Picone, Andrea;
Raimondo, Luisa;
Ferraro, Lorenzo;
Hogan, Conor;
Palummo, Maurizia;
Brambilla, Alberto;
Finazzi, Marco;
Duò, Lamberto;
Sassella, Adele;
Ciccacci, Franco

Publication type:

Article

How does tautomerization affect the excited-state dynamics of an amino acid-derivatized corrole?

Published in:

Photosynthesis Research, 2021, v. 148, n. 1/2, p. 67, doi. 10.1007/s11120-021-00824-4

By:

Clark, John A.;
Orłowski, Rafał;
Derr, James B.;
Espinoza, Eli M.;
Gryko, Daniel T.;
Vullev, Valentine I.

Publication type:

Article

THERMAL, MAGNETIC AND SPECTRAL STUDIES OF METAL-QUINONE COMPLEXES.

Published in:

Journal of Thermal Analysis & Calorimetry, 2005, v. 79, n. 3, p. 669, doi. 10.1007/s10973-005-0594-9

By:

Salunke-Gawali, S.;
Rane, S. Y.;
Boukheddaden, K.;
Codjovi, E.;
Linares, J.;
Varret, F.;
Bakare, P. P.

Publication type:

Article

Electron Microscopy of Ammonium Urate Crystallization under Tautomerism.

Published in:

2023

By:

Tang, Weiwei;
Robles, Francisco C;
Kisielowski, Christian;
Calderon, Hector A;
Rimmer, Jeffrey D

Publication type:

Abstract

Understanding the Structure of Protonated Box Ligands: Insights from Spectroscopy and Computational Studies.

Published in:

Helvetica Chimica Acta, 2025, v. 108, n. 5, p. 1, doi. 10.1002/hlca.202400205

By:

Gorbachev, Vladimir;
van Tetering, Lara;
Martens, Jonathan;
Oomens, Jos;
Berden, Giel;
Tsybizova, Alexandra;
Chen, Peter

Publication type:

Article

Short Syntheses of some 'Decalin‐1,8‐diones' and their Derivatives: Breaking the Pretended Symmetry.

Published in:

Helvetica Chimica Acta, 2019, v. 102, n. 6, p. N.PAG, doi. 10.1002/hlca.201800231

By:

Knorr, Rudolf;
Nadolny, Annette;
Hauer, Hermann;
Böhrer, Petra

Publication type:

Article

Synthesis and Solution Structure of 1 H-Benzo-1,5-diazepine Derivatives with a Perfluoroalkyl Side Chain.

Published in:

Helvetica Chimica Acta, 2016, v. 99, n. 5, p. 361, doi. 10.1002/hlca.201500264

By:

Desens, Willi;
Winterberg, Marleen;
Michalik, Dirk;
Langer, Peter

Publication type:

Article

Ground-State Tautomerism and Excited-State Proton Transfer in 7-Hydroxy-4-methyl-8-((phenylimino)methyl)-2H-chromen-2-one as a Potential Proton Crane.

Published in:

Physchem, 2024, v. 4, n. 1, p. 91, doi. 10.3390/physchem4010007

By:

Nedeltcheva-Antonova, Daniela;
Antonov, Liudmil

Publication type:

Article

Abraham Model Solute Descriptors for Favipiravir: Case of Tautomeric Equilibrium and Intramolecular Hydrogen-Bond Formation.

Published in:

Thermo, 2023, v. 3, n. 3, p. 443, doi. 10.3390/thermo3030027

By:

Yao, Emily;
Acree Jr., William E.

Publication type:

Article

Delivery of Capecitabine by Single-Walled Carbon Nanotube.

Published in:

Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 5, p. 449, doi. 10.1142/S2737416521500241

By:

Amini, Saeed K.

Publication type:

Article

2-METHYLQUINAZOLIN-4-YLIDENECYANOACETIC ACID ETHYL ESTER.

Published in:

Journal of Research in Pharmacy, 2023, v. 27, p. 51

By:

TULYASHEVA, Muborak Azimovna

Publication type:

Article

Mechanochromism induced through the interplay between excimer reaction and excited state intramolecular proton transfer.

Published in:

Communications Chemistry, 2019, v. 2, n. 1, p. N.PAG, doi. 10.1038/s42004-019-0113-8

By:

Wei, Yu-Chen;
Zhang, Zhiyun;
Chen, Yi-An;
Wu, Cheng-Ham;
Liu, Zong-Ying;
Ho, Ssu-Yu;
Liu, Jiun-Chi;
Lin, Jia-An;
Chou, Pi-Tai

Publication type:

Article

Determination of individual stability constants of coexisting molecular complexes formed by unresolvable isomers.

Published in:

Supramolecular Chemistry, 2019, v. 31, n. 2, p. 89, doi. 10.1080/10610278.2018.1544370

By:

Inoue, Motomichi;
Virués, Claudia;
Higuera-Ciapara, Inocencio

Publication type:

Article

Electroanalytical and spectral investigation of organic receptors as colorimetric and absorption ratiometric anion chemosensor.

Published in:

Supramolecular Chemistry, 2018, v. 30, n. 2, p. 103, doi. 10.1080/10610278.2017.1363392

By:

Pangannaya, Srikala;
Thimaradka, Vikram;
Trivedi, Darshak R.

Publication type:

Article

Solid-state structures of ureidoimidazoles.

Published in:

Supramolecular Chemistry, 2011, v. 23, n. 6, p. 470, doi. 10.1080/10610278.2010.550289

By:

McGhee, AndreaM.;
Plante, JeffreyP.;
Kilner, ColinA.;
Wilson, AndrewJ.

Publication type:

Article

Solid-state hydrogen-bonding self-assemblies and keto-enol tautomerism of 1,3-dipyrrolyl-1,3-propanediones.

Published in:

Supramolecular Chemistry, 2011, v. 23, n. 3/4, p. 209, doi. 10.1080/10610278.2010.521834

By:

Haketa, Yohei;
Eifuku, Nazuki;
Bando, Yuya;
Yamada, Ippei;
Hagihara, Ayano;
Maeda, Hiromitsu

Publication type:

Article

REGIOISOMERIC N-ALKYLATION OF SOME INDAZOLES.

Published in:

Journal of Faculty of Pharmacy of Ankara University / Ankara Üniversitesi Eczacilik Fakültesi Dergisi, 2025, v. 49, n. 1, p. 103, doi. 10.33483/jfpau.1571272

By:

DOGANC, Fatima;
GOKER, Hakan

Publication type:

Article

The crystal and molecular structure of (R)-sirtinol – C26H22N2O2 – a chemo-sensitive enhancer and ligand in metal complexes with important bio-inorganic applications.

Published in:

Zeitschrift für Kristallographie. Crystalline Materials, 2024, v. 239, n. 9/10, p. 315, doi. 10.1515/zkri-2024-0073

By:

Bernal, Ivan;
Lalancette, Roger A.;
Hudaihed, Ahmad;
Kucheryavy, Pavel

Publication type:

Article

<italic>N</italic> Donor substituted acetylacetones – versatile ditopic ligands.

Published in:

Zeitschrift für Kristallographie. Crystalline Materials, 2018, v. 233, n. 7, p. 437, doi. 10.1515/zkri-2017-2131

By:

Kremer, Marius;
Englert, Ulli

Publication type:

Article

Crystal structures of 1-hydroxylimidazole and imidazole 1-oxide derivatives.

Published in:

Zeitschrift für Kristallographie. Crystalline Materials, 2014, v. 229, n. 10, p. 709, doi. 10.1515/zkri-2014-1766

By:

da Silva, Ramon Borges;
da Silva, Edson Ferreira;
Carvalho, Samir Aquino;
Fraga, Carlos Alberto Manssour;
Wardell, Solange M.S.V.;
Wardell, James L.

Publication type:

Article

Solvent Influence on Absorption Spectra and Tautomeric Equilibria of Symmetric Azomethine‐Functionalized Derivatives: Structural Elucidation and Computational Studies.

Published in:: ChemistryOpen, 2022, v. 11, n. 2, p. 1, doi. 10.1002/open.202100237
Publication type:: Article

Designing Self‐Assembled Rosettes: Why Ammeline is a Superior Building Block to Melamine.

Published in:

ChemistryOpen, 2019, v. 8, n. 2, p. 134, doi. 10.1002/open.201900001

By:

Petelski, André Nicolai;
Fonseca Guerra, Célia

Publication type:

Article

Synthesis, Spectroscopic Characterization, and Time‐Dependent DFT Calculations of 1‐Methyl‐5‐phenyl‐5H‐pyrido[1,2‐a]quinazoline‐3,6‐dione and Its Starting Precursor in Different Solvents.

Published in:

ChemistryOpen, 2018, v. 7, n. 10, p. 814, doi. 10.1002/open.201800146

By:

Hamada, Nagwa M. M.

Publication type:

Article

Lewis‐Acid‐assisted Hydrogen Atom Transfer to Manganese(V)‐Oxo Corrole through Valence Tautomerization.

Published in:

ChemistryOpen, 2016, v. 5, n. 6, p. 522, doi. 10.1002/open.201600117

By:

Bougher, Curt J.;
Abu‐Omar, Mahdi M.

Publication type:

Article

Ultrafast excited‐state dynamics of gas‐phase 5‐methylcytosine tautomers.

Published in:

Journal of the Chinese Chemical Society, 2022, v. 69, n. 1, p. 107, doi. 10.1002/jccs.202100254

By:

Ho, Jr‐Wei;
Cheng, Po‐Yuan

Publication type:

Article

2‐Hydroxy‐5‐nitropyridine and 5‐nitro‐2‐pyridone: Tautomerism, infrared, Raman, and NMR spectral interpretations, normal coordinate analysis, and DFT calculations.

Published in:

Journal of the Chinese Chemical Society, 2021, v. 68, n. 10, p. 1863, doi. 10.1002/jccs.202100064

By:

Mohamed, Tarek A.;
Shaaban, Ibrahim A.;
Soliman, Usama A.;
Zoghaib, Wajdi M.

Publication type:

Article

Hydrogen-bonding Structures and Energetics of Acrylamide Isomers, Tautomers, and Dimers: An ab initio Study and Spectral Analysis.

Published in:

Journal of the Chinese Chemical Society, 2016, v. 63, n. 12, p. 968, doi. 10.1002/jccs.201600273

By:

Wang, Yi‐Siang;
Lin, Yi‐De;
Chao, Sheng Der

Publication type:

Article

Visualization and Analysis of Complex Reaction Data: The Case of Tautomeric Equilibria.

Published in:

Molecular Informatics, 2018, v. 37, n. 9/10, p. 1, doi. 10.1002/minf.201800056

By:

Glavatskikh, Marta;
Madzhidov, Timur;
Baskin, Igor I.;
Horvath, Dragos;
Nugmanov, Ramil;
Gimadiev, Timur;
Marcou, Gilles;
Varnek, Alexandre

Publication type:

Article

A Branch-and-Bound Approach for Tautomer Enumeration.

Published in:

Molecular Informatics, 2015, v. 34, n. 5, p. 263, doi. 10.1002/minf.201400128

By:

Thalheim, Torsten;
Wagner, Barbara;
Kühne, Ralph;
Middendorf, Martin;
Schüürmann, Gerrit

Publication type:

Article

Ambit-Tautomer: An Open Source Tool for Tautomer Generation.

Published in:

Molecular Informatics, 2013, v. 32, n. 5/6, p. 481, doi. 10.1002/minf.201200133

By:

Kochev, Nikolay T.;
Paskaleva, Vesselina H.;
Jeliazkova, Nina

Publication type:

Article

Protoss: a holistic approach to predict tautomers and protonation states in protein-ligand complexes.

Published in:

Journal of Cheminformatics, 2014, v. 6, n. 1, p. 1, doi. 10.1186/1758-2946-6-12

By:

Bietz, Stefan;
Urbaczek, Sascha;
Schulz, Benjamin;
Rarey, Matthias

Publication type:

Article

FMCS: a novel algorithm for the multiple MCS problem.

Published in:

Journal of Cheminformatics, 2013, v. 5, n. S1, p. 1, doi. 10.1186/1758-2946-5-S1-O6

By:

Dalke, Andrew;
Hastings, Janna

Publication type:

Article

Non-continuum solvation using the EC-RISM method applied to predict tautomer ratios, pKa and enantiomeric excess of alkylation reactions.

Published in:

2012

By:

Heil, Jochen;
Frach, Roland;
Kast, Stefan M.

Publication type:

Abstract

Building an R&D chemical registration system.

Published in:

Journal of Cheminformatics, 2012, v. 4, n. 1, p. 11, doi. 10.1186/1758-2946-4-11

By:

Martin, Elyett;
Monge, Aurï¿½lien;
Duret, Jacques-Antoine;
Gualandi, Federico;
Peitsch, Manuel C;
Popspisil, Pavel

Publication type:

Article

Diagnostic of tautomer behaviour on QSAR models and AM1 optimisation.

Published in:

2011

By:

Thalheim, T.;
Wondrousch, D.;
Stöckl, S.;
Mulliner, D.;
Ebert, R-U;
Kühne, R.;
Schüürmann, G.

Publication type:

Abstract

Hydrogen placement in protein-ligand complexes under consideration of tautomerism.

Published in:

2011

By:

Bietz, S.;
Urbaczek, S.;
Rarey, M.

Publication type:

Abstract

Ligand-side tautomer enumeration and scoring for structure-based drug-design.

Published in:

2010

By:

Seidel, Thomas;
Wolber, G.

Publication type:

Abstract

A Branch-and-Bound approach for tautomer enumeration.

Published in:

2010

By:

Thalheim, Torsten;
Ebert, R.-U.;
Kühne, R.;
Schüürmann, G.

Publication type:

Abstract

Computational Study of the Keto-Enol Tautomerism of 3-Phenyl-2,4-Pentanedione in the Gaseous Phase and Solvents Using DFT Methods.

Published in:

Oriental Journal of Chemistry, 2023, v. 39, n. 1, p. 40, doi. 10.13005/ojc/390105

By:

BABIKER, MUSA E. MOHAMED;
ALZHARANI, AHMED A.;
BAKRY, AYYOB M.

Publication type:

Article

Synthesis, Characterization, Antibacterial, Antifungal, Antioxidant and Anti-inflammatory Actions of Novel β-diketone Complex.

Published in:

Oriental Journal of Chemistry, 2019, v. 35, n. 6, p. 1799, doi. 10.13005/ojc/350624

By:

BIBAVE, SACHIN GOVIND;
ATHARE, A. E.

Publication type:

Article

Single-molecule chemistry: Knowing your neighbours.

Published in:

Nature Chemistry, 2014, v. 6, n. 1, p. 8, doi. 10.1038/nchem.1823

By:

Liljeroth, Peter

Publication type:

Article

Reduction of aflatoxin B1 to aflatoxicol: A comprehensive DFT study provides clues to its toxicity.

Published in:

Journal of the Science of Food & Agriculture, 2014, v. 94, n. 15, p. 3134, doi. 10.1002/jsfa.6663

By:

Karabulut, Sedat;
Paytakov, Guvanchmyrat;
Leszczynski, Jerzy

Publication type:

Article

The thermochemical, structural, and spectroscopic analyses of the tautomers of sulfur and selenium modified emissive nucleobases.

Published in:

Canadian Journal of Chemistry, 2021, v. 99, n. 4, p. 390, doi. 10.1139/cjc-2020-0294

By:

Parshotam, Shyam;
Joy, Megan;
Rossano-Tapia, Maria;
Mora-Gomez, V. A.;
Brown, Alex

Publication type:

Article

A computational study on new oxidizers as replacements for ammonium perchlorate: tetranitroacetimidic acid and tetranitroacetamide.

Published in:

Canadian Journal of Chemistry, 2017, v. 95, n. 2, p. 199, doi. 10.1139/cjc-2016-0468

By:

Zhang, Xueli;
Gong, Xuedong

Publication type:

Article