Publikationer inom organisk kemi
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1-Phospha-Butadienes and 1H-Phospholes via Alkynylation of Acetylenic Phosphaalkenes
Ingår i ChemPlusChem, 2023.
DOI för 1-Phospha-Butadienes and 1H-Phospholes via Alkynylation of Acetylenic Phosphaalkenes Ladda ner fulltext (pdf) av 1-Phospha-Butadienes and 1H-Phospholes via Alkynylation of Acetylenic Phosphaalkenes
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Autoantibodies to Disease-Related Proteins in Joints as Novel Biomarkers for the Diagnosis of Rheumatoid Arthritis
Ingår i Arthritis & Rheumatology, s. 1110-1119, 2023.
DOI för Autoantibodies to Disease-Related Proteins in Joints as Novel Biomarkers for the Diagnosis of Rheumatoid Arthritis Ladda ner fulltext (pdf) av Autoantibodies to Disease-Related Proteins in Joints as Novel Biomarkers for the Diagnosis of Rheumatoid Arthritis
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Benzo[b]naphtho[2,1-d]furans and 2-Phenylnaphthalenes from Streblus usambarensis
Ingår i Journal of Natural Products, s. 1010-1018, 2023.
DOI för Benzo[b]naphtho[2,1-d]furans and 2-Phenylnaphthalenes from Streblus usambarensis Ladda ner fulltext (pdf) av Benzo[b]naphtho[2,1-d]furans and 2-Phenylnaphthalenes from Streblus usambarensis
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Conducting Redox Polymers as Active Materials in Secondary Batteries
Ingår i 74th Annual Meeting of the International Society of Electrochemistry, 2023.
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Conformational Sampling Deciphers the Chameleonic Properties of a VHL-Based Degrader
Ingår i Pharmaceutics, 2023.
DOI för Conformational Sampling Deciphers the Chameleonic Properties of a VHL-Based Degrader Ladda ner fulltext (pdf) av Conformational Sampling Deciphers the Chameleonic Properties of a VHL-Based Degrader
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Crotofolane Diterpenoids and Other Constituents Isolated from Croton kilwae
Ingår i Journal of Natural Products, s. 380-389, 2023.
DOI för Crotofolane Diterpenoids and Other Constituents Isolated from Croton kilwae Ladda ner fulltext (pdf) av Crotofolane Diterpenoids and Other Constituents Isolated from Croton kilwae
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Design, Synthesis, and Antiviral Activities of New Benzotriazole-Based Derivatives
Ingår i Pharmaceuticals, 2023.
DOI för Design, Synthesis, and Antiviral Activities of New Benzotriazole-Based Derivatives Ladda ner fulltext (pdf) av Design, Synthesis, and Antiviral Activities of New Benzotriazole-Based Derivatives
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Detection of Heavy Metals in Food and Agricultural Products by Surface-enhanced Raman Spectroscopy
Ingår i Food reviews international (Print), s. 1440-1461, 2023.
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Do non-coordinating polymers function as host materials for solid polymer electrolytes?: The case of PVdF-HFP
Ingår i Journal of Materials Chemistry A, s. 15329-15335, 2023.
DOI för Do non-coordinating polymers function as host materials for solid polymer electrolytes?: The case of PVdF-HFP Ladda ner fulltext (pdf) av Do non-coordinating polymers function as host materials for solid polymer electrolytes?: The case of PVdF-HFP
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Engineered Aldolases Catalyzing Stereoselective Aldol Reactions Between Aryl-Substituted Ketones and Aldehydes
Ingår i Catalysis Science & Technology, 2023.
DOI för Engineered Aldolases Catalyzing Stereoselective Aldol Reactions Between Aryl-Substituted Ketones and Aldehydes Ladda ner fulltext (pdf) av Engineered Aldolases Catalyzing Stereoselective Aldol Reactions Between Aryl-Substituted Ketones and Aldehydes
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Ensemble determination by NMR data deconvolution
Ingår i Nature Reviews Chemistry, s. 511-524, 2023.
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Going Viral: An Investigation into the Chameleonic Behaviour of Antiviral Compounds
Ingår i Chemistry - A European Journal, 2023.
DOI för Going Viral: An Investigation into the Chameleonic Behaviour of Antiviral Compounds Ladda ner fulltext (pdf) av Going Viral: An Investigation into the Chameleonic Behaviour of Antiviral Compounds
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Macrocycles in Drug Discovery?Learning from the Past for the Future
Ingår i Journal of Medicinal Chemistry, s. 5377-5396, 2023.
DOI för Macrocycles in Drug Discovery?Learning from the Past for the Future Ladda ner fulltext (pdf) av Macrocycles in Drug Discovery?Learning from the Past for the Future
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Macrocyclic Pyrrolizidine Alkaloids and Silphiperfolanol Angelate Esters from Solanecio mannii
Ingår i European Journal of Organic Chemistry, 2023.
DOI för Macrocyclic Pyrrolizidine Alkaloids and Silphiperfolanol Angelate Esters from Solanecio mannii Ladda ner fulltext (pdf) av Macrocyclic Pyrrolizidine Alkaloids and Silphiperfolanol Angelate Esters from Solanecio mannii
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N,2,6-Trisubstituted 1H-benzimidazole derivatives as a new scaffold of antimicrobial and anticancer agents: design, synthesis, in vitro evaluation, and in silico studies
Ingår i RSC Advances, s. 399-420, 2023.
DOI för N,2,6-Trisubstituted 1H-benzimidazole derivatives as a new scaffold of antimicrobial and anticancer agents: design, synthesis, in vitro evaluation, and in silico studies Ladda ner fulltext (pdf) av N,2,6-Trisubstituted 1H-benzimidazole derivatives as a new scaffold of antimicrobial and anticancer agents: design, synthesis, in vitro evaluation, and in silico studies
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N-methyl-O-benzylhydroxylamine derivatives of sialylated oligosaccharides, their synthesis and separation with reversed-phase HPLC
Ingår i Carbohydrate Research, 2023.
DOI för N-methyl-O-benzylhydroxylamine derivatives of sialylated oligosaccharides, their synthesis and separation with reversed-phase HPLC Ladda ner fulltext (pdf) av N-methyl-O-benzylhydroxylamine derivatives of sialylated oligosaccharides, their synthesis and separation with reversed-phase HPLC
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Numerical simulation of peristalsis to study co-localization and intestinal distribution of a macromolecular drug and permeation enhancer
Ingår i International Journal of Biological Macromolecules, 2023.
DOI för Numerical simulation of peristalsis to study co-localization and intestinal distribution of a macromolecular drug and permeation enhancer Ladda ner fulltext (pdf) av Numerical simulation of peristalsis to study co-localization and intestinal distribution of a macromolecular drug and permeation enhancer
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Photoinduced ring‐opening and phototoxicity of an indolin‐3‐one derivative
Ingår i Chemistry - A European Journal, 2023.
DOI för Photoinduced ring‐opening and phototoxicity of an indolin‐3‐one derivative
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Redox-site accessibility of composites containing a 2D redox-active covalent organic framework: from optimization to application
Ingår i Journal of Materials Chemistry A, s. 13923-13931, 2023.
DOI för Redox-site accessibility of composites containing a 2D redox-active covalent organic framework: from optimization to application Ladda ner fulltext (pdf) av Redox-site accessibility of composites containing a 2D redox-active covalent organic framework: from optimization to application
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Doloczki, Susanne
Shining Light on Benzothiadiazoles and Indolines: Photophysical Properties and Cancer Cell Imaging
2023.
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Simulation Reveals the Chameleonic Behavior of Macrocycles
Ingår i Journal of Chemical Information and Modeling, s. 138-146, 2023.
DOI för Simulation Reveals the Chameleonic Behavior of Macrocycles Ladda ner fulltext (pdf) av Simulation Reveals the Chameleonic Behavior of Macrocycles
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Smooth Things Come in Threes: A Diabatic Surrogate Model for Conical Intersection Optimization
Ingår i Journal of Chemical Theory and Computation, s. 3418-3427, 2023.
DOI för Smooth Things Come in Threes: A Diabatic Surrogate Model for Conical Intersection Optimization Ladda ner fulltext (pdf) av Smooth Things Come in Threes: A Diabatic Surrogate Model for Conical Intersection Optimization
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Structure-based virtual screening discovers potent and selective adenosine A1 receptor antagonists
Ingår i European Journal of Medicinal Chemistry, 2023.
DOI för Structure-based virtual screening discovers potent and selective adenosine A1 receptor antagonists Ladda ner fulltext (pdf) av Structure-based virtual screening discovers potent and selective adenosine A1 receptor antagonists
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Tetraphenylporphyrin electrocatalysts for the hydrogen evolution reaction: applicability of molecular volcano plots to experimental operating conditions
Ingår i Dalton Transactions, s. 10348-10362, 2023.
DOI för Tetraphenylporphyrin electrocatalysts for the hydrogen evolution reaction: applicability of molecular volcano plots to experimental operating conditions Ladda ner fulltext (pdf) av Tetraphenylporphyrin electrocatalysts for the hydrogen evolution reaction: applicability of molecular volcano plots to experimental operating conditions
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The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry
Ingår i Journal of Chemical Theory and Computation, s. 6933-6991, 2023.
DOI för The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry
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Therapy targeting antigen-specific T cells by a peptide-based tolerizing vaccine against autoimmune arthritis
Ingår i Proceedings of the National Academy of Sciences of the United States of America, 2023.
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A Guide to Low-Valent Titanocene Complexes as Tunable Single-Electron Transfer Catalysts for Applications in Organic Chemistry
Ingår i ChemCatChem, 2022.
DOI för A Guide to Low-Valent Titanocene Complexes as Tunable Single-Electron Transfer Catalysts for Applications in Organic Chemistry Ladda ner fulltext (pdf) av A Guide to Low-Valent Titanocene Complexes as Tunable Single-Electron Transfer Catalysts for Applications in Organic Chemistry
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A new β-hydroxydihydrochalcone from Tephrosia uniflora, and the revision of three β-hydroxydihydrochalcones to flavanones
Ingår i Fitoterapia, 2022.
DOI för A new β-hydroxydihydrochalcone from Tephrosia uniflora, and the revision of three β-hydroxydihydrochalcones to flavanones Ladda ner fulltext (pdf) av A new β-hydroxydihydrochalcone from Tephrosia uniflora, and the revision of three β-hydroxydihydrochalcones to flavanones
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Catalytic Asymmetric β‐Oxygen Elimination
Ingår i Angewandte Chemie International Edition, 2022.
DOI för Catalytic Asymmetric β‐Oxygen Elimination Ladda ner fulltext (pdf) av Catalytic Asymmetric β‐Oxygen Elimination
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Palica, Katarzyna
Development of phosphorus-containing metallo-β-lactamase inhibitors: Synthesis and binding studies by solution NMR and molecular docking
2022.
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Umereweneza, Daniel
Discovery of Secondary Metabolites from Rwandese Medicinal Plants: Isolation, Characterization and Biological Activity
2022.
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Dual Functional High Donor Electrolytes for Lithium-Sulfur Batteries under Lithium Nitrate Free and Lean Electrolyte Conditions
Ingår i ACS Energy Letters, s. 2459-2468, 2022.
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Evaluation of delayed LNFPIII treatment initiation protocol on improving long-term behavioral and neuroinflammatory pathology in a mouse model of Gulf War Illness
Ingår i Brain, Behavior, and Immunity - Health, 2022.
DOI för Evaluation of delayed LNFPIII treatment initiation protocol on improving long-term behavioral and neuroinflammatory pathology in a mouse model of Gulf War Illness Ladda ner fulltext (pdf) av Evaluation of delayed LNFPIII treatment initiation protocol on improving long-term behavioral and neuroinflammatory pathology in a mouse model of Gulf War Illness
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Halogen Bond Activation in Gold Catalysis
Ingår i ACS Catalysis, s. 7210-7220, 2022.
DOI för Halogen Bond Activation in Gold Catalysis Ladda ner fulltext (pdf) av Halogen Bond Activation in Gold Catalysis
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Halogen-bonded halogen(I) ion complexes
Ingår i Reference Module in Chemistry, Molecular Sciences and Chemical Engineering, 2022.
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Ergun Dönmez, Merve
Hydroarylation of Fullerene C60 Using Arylboronic Acids via Rhodium Catalysis: Improving the Outcomes and Simplifying the Conditions
2022.
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Importance of Binding Site Hydration and Flexibility Revealed When Optimizing a Macrocyclic Inhibitor of the Keap1-Nrf2 Protein-Protein Interaction
Ingår i Journal of Medicinal Chemistry, s. 3473-3517, 2022.
DOI för Importance of Binding Site Hydration and Flexibility Revealed When Optimizing a Macrocyclic Inhibitor of the Keap1-Nrf2 Protein-Protein Interaction Ladda ner fulltext (pdf) av Importance of Binding Site Hydration and Flexibility Revealed When Optimizing a Macrocyclic Inhibitor of the Keap1-Nrf2 Protein-Protein Interaction
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Key interactions in the trimolecular complex consisting of the rheumatoid arthritis-associated DRB1*04:01 molecule, the major glycosylated collagen II peptide and the T-cell receptor
Ingår i Annals of the Rheumatic Diseases, s. 480-489, 2022.
DOI för Key interactions in the trimolecular complex consisting of the rheumatoid arthritis-associated DRB1*04:01 molecule, the major glycosylated collagen II peptide and the T-cell receptor Ladda ner fulltext (pdf) av Key interactions in the trimolecular complex consisting of the rheumatoid arthritis-associated DRB1*04:01 molecule, the major glycosylated collagen II peptide and the T-cell receptor
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Linker-Dependent Folding Rationalizes PROTAC Cell Permeability br
Ingår i Journal of Medicinal Chemistry, s. 13029-13040, 2022.
DOI för Linker-Dependent Folding Rationalizes PROTAC Cell Permeability br Ladda ner fulltext (pdf) av Linker-Dependent Folding Rationalizes PROTAC Cell Permeability br
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Posada Urrutia, Mauricio
Live long and phosphor: synthesis of new 2,1,3-benzothiadiazole based scaffolds and novel organo-Au(I) luminophores
2022.
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Modified ent-Abietane Diterpenoids from the Leaves of Suregada zanzibariensis
Ingår i Journal of Natural Products, s. 2135-2141, 2022.
DOI för Modified ent-Abietane Diterpenoids from the Leaves of Suregada zanzibariensis Ladda ner fulltext (pdf) av Modified ent-Abietane Diterpenoids from the Leaves of Suregada zanzibariensis
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NMR Backbone Assignment of VIM-2 and Identification of the Active Enantiomer of a Potential Inhibitor
Ingår i ACS Medicinal Chemistry Letters, s. 257-261, 2022.
DOI för NMR Backbone Assignment of VIM-2 and Identification of the Active Enantiomer of a Potential Inhibitor Ladda ner fulltext (pdf) av NMR Backbone Assignment of VIM-2 and Identification of the Active Enantiomer of a Potential Inhibitor
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Photophysical characterization and fluorescence cell imaging applications of 4-N-substituted benzothiadiazoles
Ingår i RSC Advances, s. 14544-14550, 2022.
DOI för Photophysical characterization and fluorescence cell imaging applications of 4-N-substituted benzothiadiazoles Ladda ner fulltext (pdf) av Photophysical characterization and fluorescence cell imaging applications of 4-N-substituted benzothiadiazoles
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PROTAC cell permeability and oral bioavailability: a journey into uncharted territory
Ingår i Future Medicinal Chemistry, s. 123-126, 2022.
DOI för PROTAC cell permeability and oral bioavailability: a journey into uncharted territory
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Regularized CASPT2: an Intruder-State-Free Approach
Ingår i Journal of Chemical Theory and Computation, s. 4814-4825, 2022.
DOI för Regularized CASPT2: an Intruder-State-Free Approach Ladda ner fulltext (pdf) av Regularized CASPT2: an Intruder-State-Free Approach
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Role of conical intersection seam topography in the chemiexcitation of 1,2-dioxetanes
Ingår i Physical Chemistry, Chemical Physics - PCCP, s. 1638-1653, 2022.
DOI för Role of conical intersection seam topography in the chemiexcitation of 1,2-dioxetanes Ladda ner fulltext (pdf) av Role of conical intersection seam topography in the chemiexcitation of 1,2-dioxetanes
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Synthesis, characterization and computational evaluation of bicyclooctadienes towards molecular solar thermal energy storage
Ingår i Chemical Science, s. 834-841, 2022.
DOI för Synthesis, characterization and computational evaluation of bicyclooctadienes towards molecular solar thermal energy storage Ladda ner fulltext (pdf) av Synthesis, characterization and computational evaluation of bicyclooctadienes towards molecular solar thermal energy storage
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Synthesis of a Series of Novel 2-Amino-5-substituted 1,3,4-oxadiazole and 1,3,4-thiadiazole Derivatives as Potential Anticancer, Antifungal and Antibacterial Agents
Ingår i Medicinal chemistry, s. 558-573, 2022.
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Ultralarge Virtual Screening Identifies SARS-CoV-2 Main Protease Inhibitors with Broad-Spectrum Activity against Coronaviruses
Ingår i Journal of the American Chemical Society, s. 2905-2920, 2022.
DOI för Ultralarge Virtual Screening Identifies SARS-CoV-2 Main Protease Inhibitors with Broad-Spectrum Activity against Coronaviruses Ladda ner fulltext (pdf) av Ultralarge Virtual Screening Identifies SARS-CoV-2 Main Protease Inhibitors with Broad-Spectrum Activity against Coronaviruses
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Antibacterial and cytotoxic prenylated dihydrochalcones from Eriosema montanum
Ingår i Fitoterapia (Milano), 2021.
DOI för Antibacterial and cytotoxic prenylated dihydrochalcones from Eriosema montanum Ladda ner fulltext (pdf) av Antibacterial and cytotoxic prenylated dihydrochalcones from Eriosema montanum
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Are bis(pyridine)iodine(i) complexes applicable for asymmetric halogenation?
Ingår i Organic and biomolecular chemistry, s. 8307-8323, 2021.
DOI för Are bis(pyridine)iodine(i) complexes applicable for asymmetric halogenation? Ladda ner fulltext (pdf) av Are bis(pyridine)iodine(i) complexes applicable for asymmetric halogenation?
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Assessing the Intrinsic Strengths of Ion-Solvent and Solvent-Solvent Interactions for Hydrated Mg2+ Clusters
Ingår i INORGANICS, 2021.
DOI för Assessing the Intrinsic Strengths of Ion-Solvent and Solvent-Solvent Interactions for Hydrated Mg2+ Clusters Ladda ner fulltext (pdf) av Assessing the Intrinsic Strengths of Ion-Solvent and Solvent-Solvent Interactions for Hydrated Mg2+ Clusters
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Biflavanones, Chalconoids, and Flavonoid Analogues from the Stem Bark of Ochna holstii
Ingår i Journal of Natural Products, s. 364-372, 2021.
DOI för Biflavanones, Chalconoids, and Flavonoid Analogues from the Stem Bark of Ochna holstii Ladda ner fulltext (pdf) av Biflavanones, Chalconoids, and Flavonoid Analogues from the Stem Bark of Ochna holstii
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Cell Permeability of Isomeric Macrocycles: Predictions and NMR Studies
Ingår i ACS Medicinal Chemistry Letters, s. 983-990, 2021.
DOI för Cell Permeability of Isomeric Macrocycles: Predictions and NMR Studies Ladda ner fulltext (pdf) av Cell Permeability of Isomeric Macrocycles: Predictions and NMR Studies
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Delayed treatment with the immunotherapeutic LNFPIII ameliorates multiple neurological deficits in a pesticide-nerve agent prophylactic mouse model of Gulf War Illness
Ingår i Neurotoxicology and Teratology, 2021.
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Begnini, Fabio
Discovery of Novel Macrocyclic Ligands for Difficult Targets: Applications to Natural Product Derived Keap1 Inhibitors
2021.
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Employing complementary spectroscopies to study the conformations of an epimeric pair of side-chain stapled peptides in aqueous solution
Ingår i RSC Advances, s. 4200-4208, 2021.
DOI för Employing complementary spectroscopies to study the conformations of an epimeric pair of side-chain stapled peptides in aqueous solution Ladda ner fulltext (pdf) av Employing complementary spectroscopies to study the conformations of an epimeric pair of side-chain stapled peptides in aqueous solution
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Fragment-based design of selective GPCR ligands guided by free energy simulations
Ingår i Chemical Communications, s. 12305-12308, 2021.
DOI för Fragment-based design of selective GPCR ligands guided by free energy simulations Ladda ner fulltext (pdf) av Fragment-based design of selective GPCR ligands guided by free energy simulations
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Halogen Bonding: An Odd Chemistry?
Ingår i The chemical record, s. 1252-1257, 2021.
DOI för Halogen Bonding: An Odd Chemistry? Ladda ner fulltext (pdf) av Halogen Bonding: An Odd Chemistry?
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Halogen Bonding: From Fundamentals to Applications
Ingår i ChemPlusChem, s. 1229-1230, 2021.
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Halogen Bonds of Iodonium Ions: A World Dissimilar to Silver Coordination
Ingår i Bulletin of the Chemical Society of Japan, s. 191-196, 2021.
DOI för Halogen Bonds of Iodonium Ions: A World Dissimilar to Silver Coordination
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Implementation of iMiDEV™, a new fully automated microfluidic platform for radiopharmaceutical production
Ingår i Lab on a Chip, s. 2272-2282, 2021.
DOI för Implementation of iMiDEV™, a new fully automated microfluidic platform for radiopharmaceutical production Ladda ner fulltext (pdf) av Implementation of iMiDEV™, a new fully automated microfluidic platform for radiopharmaceutical production
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Indolylbenzothiadiazoles as highly tunable fluorophores for imaging lipid droplet accumulation in astrocytes and glioblastoma cells
Ingår i RSC Advances, s. 23960-23967, 2021.
DOI för Indolylbenzothiadiazoles as highly tunable fluorophores for imaging lipid droplet accumulation in astrocytes and glioblastoma cells Ladda ner fulltext (pdf) av Indolylbenzothiadiazoles as highly tunable fluorophores for imaging lipid droplet accumulation in astrocytes and glioblastoma cells
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Kinetic Analysis Uncovers Hidden Autocatalysis and Inhibition Pathways in Titanium(III)-Catalyzed Ketone-Nitrile Couplings
Ingår i ACS Catalysis, s. 11451-11458, 2021.
DOI för Kinetic Analysis Uncovers Hidden Autocatalysis and Inhibition Pathways in Titanium(III)-Catalyzed Ketone-Nitrile Couplings Ladda ner fulltext (pdf) av Kinetic Analysis Uncovers Hidden Autocatalysis and Inhibition Pathways in Titanium(III)-Catalyzed Ketone-Nitrile Couplings
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Mechanochemical Solvent-Free Catalytic C-H Methylation
Ingår i Angewandte Chemie International Edition, s. 6660-6666, 2021.
DOI för Mechanochemical Solvent-Free Catalytic C-H Methylation Ladda ner fulltext (pdf) av Mechanochemical Solvent-Free Catalytic C-H Methylation
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Mining Natural Products for Macrocycles to Drug Difficult Targets
Ingår i Journal of Medicinal Chemistry, s. 1054-1072, 2021.
DOI för Mining Natural Products for Macrocycles to Drug Difficult Targets Ladda ner fulltext (pdf) av Mining Natural Products for Macrocycles to Drug Difficult Targets
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Modulating photoswitch performance with halogen, coordinative and hydrogen bonding: a comparison of relative bond strengths
Ingår i Chemical Communications, s. 6261-6263, 2021.
DOI för Modulating photoswitch performance with halogen, coordinative and hydrogen bonding: a comparison of relative bond strengths Ladda ner fulltext (pdf) av Modulating photoswitch performance with halogen, coordinative and hydrogen bonding: a comparison of relative bond strengths
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News ways of understanding the complex biology of diabetes using PET
Ingår i Nuclear Medicine and Biology, s. 65-71, 2021.
DOI för News ways of understanding the complex biology of diabetes using PET
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NMReDATA: Tools and applications
Ingår i Magnetic Resonance in Chemistry, s. 792-803, 2021.
DOI för NMReDATA: Tools and applications Ladda ner fulltext (pdf) av NMReDATA: Tools and applications
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Non-uniform sampling for NOESY?: A case study on spiramycin
Ingår i Magnetic Resonance in Chemistry, s. 723-737, 2021.
DOI för Non-uniform sampling for NOESY?: A case study on spiramycin Ladda ner fulltext (pdf) av Non-uniform sampling for NOESY?: A case study on spiramycin