Publikationer inom organisk kemi

Advanced NMR techniques for structural elucidation in medicinal chemistry

Wieske, Hermina

Till DiVA

Scott, Thais R.; Oakley, Meagan S.; Hermes, Matthew R.; Sand, Andrew M. et al.

Analytic gradients for multiconfiguration pair-density functional theory with density fitting: Development and application to geometry optimization in the ground and excited states

Ingår i Journal of Chemical Physics, 2021.

DOI Till DiVA

Kalenga, Thobias M.; Ndoile, Monica M.; Atilaw, Yoseph; Munissi, Joan J.E. et al.

Antibacterial and cytotoxic biflavonoids from the root bark of Ochna kirkii

Ingår i Fitoterapia (Milano), 2021.

Till DiVA

Umereweneza, Daniel; Atilaw, Yoseph; Rudenko, Anastasia; Gütlin, Yukino et al.

Antibacterial and cytotoxic prenylated dihydrochalcones from Eriosema montanum

Ingår i Fitoterapia (Milano), 2021.

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Chepkirui, Carolyne; Ochieng, Purity J; Sarkar, Biswajyoti; Hussain, Aabid et al.

Antiplasmodial and antileishmanial flavonoids from Mundulea sericea

Ingår i Fitoterapia (Milano), 2021.

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Kalenga, Thobias M.; Ndoile, Monica M.; Atilaw, Yoseph; Gilissen, Pieter J. et al.

Biflavanones, Chalconoids, and Flavonoid Analogues from the Stem Bark of Ochna holstii

Ingår i Journal of Natural Products, s. 364-372, 2021.

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Kalenga, Thobias M.; Ndoile, Monica M.; Atilaw, Yoseph; Gilissen, Pieter J. et al.

Biflavanones, Chalconoids, and Flavonoid Analogues from the Stem Bark of Ochna holstii

Ingår i Journal of Natural Products, 2021.

Till DiVA

Bogaerts, Jonathan; Atilaw, Yoseph; Peintner, Stefan; Aerts, Roy et al.

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.

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Turunen, Lotta; Hansen, Jørn H; Erdélyi, Máté

Halogen Bonding: An Odd Chemistry?

Ingår i The chemical record, s. 1252-1257, 2021.

Till DiVA

Turunen, Lotta; Boróka Németh, Flóra; Decato, Daniel A.; Pápai, Imre et al.

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 Till DiVA

Zhou, Yang; Kuang, Guanglin; Li, Junhao; Halldin, Christer et al.

In silico studies of ASEM analogues targeting alpha 7-nAChR and experimental verification

Ingår i RSC Advances, s. 3942-3951, 2021.

DOI Till DiVA

Begnini, Fabio; Poongavanam, Vasanthanathan; Over, Bjorn; Castaldo, Marie et al.

Mining Natural Products for Macrocycles to Drug Difficult Targets

Ingår i Journal of Medicinal Chemistry, s. 1054-1072, 2021.

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Battaglia, Stefano; Lindh, Roland

On the role of symmetry in XDW-CASPT2

Ingår i Journal of Chemical Physics, 2021.

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Reiersølmoen, Ann Christin; Battaglia, Stefano; Orthaber, Andreas; Lindh, Roland et al.

P,N-Chelated Gold(III) Complexes: Structure and Reactivity

Ingår i Journal of the American Chemical Society, 2021.

Till DiVA

Reiersolmoen, Ann Christin; Battaglia, Stefano; Orthaber, Andreas; Lindh, Roland et al.

P,N-Chelated Gold(III) Complexes: Structure and Reactivity

Ingår i Inorganic Chemistry, s. 2847-2855, 2021.

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Fernández Galván, Ignacio; Raggi, Gerardo; Lindh, Roland

Restricted-Variance Constrained, Reaction Path, and Transition State Molecular Optimizations Using Gradient-Enhanced Kriging

Ingår i Journal of Chemical Theory and Computation, s. 571-582, 2021.

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Atilaw, Yoseph; Poongavanam, Vasanthanathan; Svensson Nilsson, Caroline; Nguyen, Duy et al.

Solution Conformations Shed Light on PROTAC Cell Permeability

Ingår i ACS Medicinal Chemistry Letters, s. 107-114, 2021.

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Wilcox, Scott; Herrebout, W; Erdélyi, Máté

Spectroscopy of halogen bonding in solution

Ingår i Halogen Bonding in Solution, s. 153-194, 2021.

Till DiVA

Caron, Giulia; Kihlberg, Jan; Goetz, Gilles; Ratkova, Ekaterina et al.

Steering New Drug Discovery Campaigns: Permeability, Solubility, and Physicochemical Properties in the bRo5 Chemical Space

Ingår i ACS Medicinal Chemistry Letters, s. 13-23, 2021.

DOI Till DiVA

Guo, Xiaohu; Söderholm, Annika; Kanchugal Puttaswamy, Sandesh; Isaksen, Geir V et al.

Structure and mechanism of a phage-encoded SAM lyase revises catalytic function of enzyme family

Ingår i eLIFE, 2021.

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Reutskaya, Elena; Sapegin, Alexander; Peintner, Stefan; Erdélyi, Máté et al.

Sulfur Oxidation Increases the Rate of HIRE-Type [1.4]Thiazepinone Ring Expansion and Influences the Conformation of a Medium-Sized Heterocyclic Scaffold

Ingår i Journal of Organic Chemistry, s. 5778-5791, 2021.

DOI Till DiVA

Turunen, Lotta; Erdélyi, Máté

The three-center halogen bond

Ingår i Halogen Bonding in Solution, s. 121-151, 2021.

Till DiVA

Maeda, Gasper; Munissi, Joan J. E.; Lindblad, Sofia; Duffy, Sandra et al.

A Meroisoprenoid, Heptenolides, and C-Benzylated Flavonoids from Sphaerocoryne gracilis ssp. gracilis

Ingår i Journal of Natural Products, s. 316-322, 2020.

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Grintsevich, Sergey; Sapegin, Alexander; Reutskaya, Elena; Peintner, Stefan et al.

An Alternative Approach to the Hydrated Imidazoline Ring Expansion (HIRE) of Diarene-Fused [1.4]Oxazepines

Ingår i European Journal of Organic Chemistry, s. 5664-5676, 2020.

DOI Till DiVA

Mamedov, Ibrahim G.; Naghiyev, Farid; Maharramov, Abel; Uwangue, Owens et al.

Antibacterial activity of 2-amino-3-cyanopyridine derivatives

Ingår i Mendeleev communications (Print), s. 498-499, 2020.

DOI Till DiVA

Begum, Sartaz; Munissi, Joan J.E.; Buriyo, Amelia S.; Makangara, John J. et al.

Antiplasmodial, Antimicrobial and Cytotoxic Activities of Extracts from Selected Medicinal Plants Growing in Tanzania

Ingår i Journal of Biologically Active Products from Nature, s. 165-176, 2020.

DOI Till DiVA

Mote, Ryan S.; Carpenter, Jessica M.; Dockman, Rachel L.; Steinberger, Andrew J. et al.

Assessing the Beneficial Effects of the Immunomodulatory Glycan LNFPIII on Gut Microbiota and Health in a Mouse Model of Gulf War Illness

Ingår i International Journal of Environmental Research and Public Health, 2020.

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von der Heiden, Daniel; Rissanen, Kari; Erdélyi, Máté

Asymmetric [N–I–N]+ halonium complexes in solution?

Ingår i Chemical Communications, s. 14431-14434, 2020.

DOI Till DiVA

Jeong, WooSeok; Stoneburner, Samuel J.; King, Daniel; Li, Ruye et al.

Automation of Active Space Selection for Multireference Methods via Machine Learning on Chemical Bond Dissociation

Ingår i Journal of Chemical Theory and Computation, s. 2389-2399, 2020.

DOI Till DiVA

Petersen, Daniel; Reinholdt, Peter; Szomek, Maria; Hansen, Selina Kruuse et al.

Binding and intracellular transport of 25-hydroxycholesterol by Niemann-Pick C2 protein

Ingår i Biochimica et Biophysica Acta - Biomembranes, 2020.

DOI Till DiVA

Andersson, Hanna; Jarvoll, Patrik; Yang, Shao-Kang; Yang, Ke-Wu et al.

Binding of 2-(Triazolylthio)acetamides to Metallo-beta-lactamase CcrA Determined with NMR

Ingår i ACS Omega, s. 21570-21578, 2020.

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Li, Yanpeng; Tong, Dongmei; Liang, Peibin; Lönnblom, Erik et al.

Cartilage-binding antibodies initiate joint inflammation and promote chronic erosive arthritis

Ingår i Arthritis Research & Therapy, 2020.

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Reiersoelmoen, Ann Christin; Csókás, Dániel; Oeien-Oedegaard, Sigurd; Vanderkooy, Alan et al.

Catalytic Activity of trans-Bis(pyridine)gold Complexes

Ingår i Journal of the American Chemical Society, s. 6439-6446, 2020.

DOI Till DiVA

Peintner, Stefan

Characterising Halogen Bonding in a Cooperative Model System

Till DiVA

Schalk, Oliver; Galiana, Joachim; Geng, Ting; Larsson, Tobias et al.

Competition between ring-puckering and ring-opening excited state reactions exemplified on 5H-furan-2-one and derivatives

Ingår i Journal of Chemical Physics, 2020.

DOI Till DiVA

Palica, Katarzyna; Andersson, Hanna; Erdélyi, Máté

Development of Metallo-β-lactamase Inhibitorsto Control Antibiotic Resistance

2020.

Till DiVA

Ballante, Flavio; Rudling, Axel; Zeifman, Alexey; Luttens, Andreas et al.

Docking Finds GPCR Ligands in Dark Chemical Matter

Ingår i Journal of Medicinal Chemistry, s. 613-620, 2020.

DOI Till DiVA

Tyagi, Mohit; Begnini, Fabio; Poongavanam, Vasanthanathan; Doak, Bradley C. et al.

Drug Syntheses Beyond the Rule of 5

Ingår i Chemistry - A European Journal, s. 49-88, 2020.

DOI Till DiVA

Kumar, Amit; Kumar, Rajnish; Flanagan, John; Långström, Bengt et al.

Esomeprazole reduces sperm motility index by targeting the spermic cholinergic machinery: A mechanistic study for the association between use of proton pump inhibitors and reduced sperm motility index

Ingår i Biochemical Pharmacology, 2020.

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Delcey, Mickael G; Couto, Rafael Carvalho; Sorensen, Lasse Kragh; Fernández Galván, Ignacio et al.

Exact semi-classical light-matter interaction operator applied to two-photon processes with strong relativistic effects

Ingår i Journal of Chemical Physics, 2020.

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Battaglia, Stefano; Lindh, Roland

Extended Dynamically Weighted CASPT2: The Best of Two Worlds

Ingår i Journal of Chemical Theory and Computation, s. 1555-1567, 2020.

DOI Till DiVA

Sethio, Daniel; Raggi, Gerardo; Lindh, Roland; Erdélyi, Máté

Halogen bond of halonium ions: Benchmarking DFT methods for the description of NMR chemical shifts

Ingår i Journal of Chemical Theory and Computation, s. 7690-7701, 2020.

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von der Heiden, Daniel; Vanderkooy, Alan; Erdélyi, Máté

Halogen bonding in solution: NMR spectroscopic approaches

Ingår i Coordination chemistry reviews, 2020.

DOI Till DiVA

Turunen, Lotta; Erdélyi, Máté

Halogen bonds of halonium ions

Ingår i Chemical Society Reviews, s. 2688-2700, 2020.

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Slanina, Tomáš; Ayub, Rabia; Toldo, Josene; Sundell, Johan et al.

Impact of Excited-State Antiaromaticity Relief in a Fundamental Benzene Photoreaction Leading to Substituted Bicyclo[3.1.0]hexenes

Ingår i Journal of the American Chemical Society, s. 10942-10954, 2020.

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Alvebratt, Caroline; Dening, Tahnee J; Åhlén, Michelle; Cheung, Ocean et al.

In Vitro Performance and Chemical Stability of Lipid-Based Formulations Encapsulated in a Mesoporous Magnesium Carbonate Carrier

Ingår i Pharmaceutics, 2020.

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Billinger, Erika; Viljanen, Johan V.; Lind, Sara; Johansson, Gunnar

Inhibition properties of free and conjugated leupeptin analogues.

Ingår i FEBS Open Bio, s. 2605-2615, 2020.

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Vasil'ev, A. A.; Engman, Lars; Serebryakov, E. P.

Intramolecular alkene-alkyne metathesis and 1,4-cis-hydrogenation as a stereocontrolled route to compounds with exocyclic double bonds

Ingår i Russian chemical bulletin, s. 169-171, 2020.

DOI Till DiVA

Lindfors, Lina; Sundström, Linda; Fröderberg Roth, Linda; Meuller, Johan et al.

Is GPR146 really the receptor for proinsulin C-peptide?

Ingår i Bioorganic & Medicinal Chemistry Letters, 2020.

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Delgado, Alexis A. A.; Sethio, Daniel; Munar, Ipek; Aviyente, Viktorya et al.

Local vibrational mode analysis of ion-solvent and solvent-solvent interactions for hydrated Ca2+ clusters

Ingår i Journal of Chemical Physics, 2020.

DOI Till DiVA

Yang, Jie; Talibov, Vladimir O; Peintner, Stefan; Rhee, Claire et al.

Macrocyclic Peptides Uncover a Novel Binding Mode for Reversible Inhibitors of LSD1

Ingår i ACS Omega, s. 3979-3995, 2020.

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Ingner, Fredric; Giustra, Zachary X.; Novosedlik, Sebastian; Orthaber, Andreas et al.

Mechanochemical synthesis of (hetero)aryl Au(i) complexes

Ingår i Green Chemistry, s. 5648-5655, 2020.

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Ingner, Fredric; Schmitt, Ann-Cathrin; Orthaber, Andreas; Gates, Paul J. et al.

Mild and Efficient Synthesis of Diverse Organo-Au-I-L Complexes in Green Solvents

Ingår i ChemSusChem, s. 2032-2037, 2020.

DOI Till DiVA

Aquilante, Francesco; Autschbach, Jochen; Baiardi, Alberto; Battaglia, Stefano et al.

Modern quantum chemistry with [Open]Molcas

Ingår i Journal of Chemical Physics, 2020.

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Lindfors, Lina

Molecular Imaging of Diabetic Kidney Tissue and Binding Studies of Proinsulin C-peptide

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Ramadhin, Jessica; Silva-Moraes, Vanessa; Norberg, Thomas; Harn, Donald

Monoclonal Antibodies Generated against Glycoconjugates Recognize Chemical Linkers

Ingår i ANTIBODIES, 2020.

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Carpenter, J. M.; Gordon, H. E.; Ludwig, H. D.; Wagner, J. J. et al.

Neurochemical and neuroinflammatory perturbations in two Gulf War Illness models: Modulation by the immunotherapeutic LNFPIII

Ingår i Neurotoxicology, s. 40-50, 2020.

DOI Till DiVA

Sankari, Anna; Stråhlman, Christian; Sankari, Rami; Partanen, Leena et al.

Non-radiative decay and fragmentation in water molecules after 1a₁^-14a₁ excitation and core ionization studied by electron-energy-resolved electron–ion coincidence spectroscopy

Ingår i Journal of Chemical Physics, 2020.

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Lindblad, Sofia; Nemeth, Flora Boroka; Foldes, Tamas; Vanderkooy, Alan et al.

O-I-O halogen bond of halonium ions

Ingår i Chemical Communications, s. 9671-9674, 2020.

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Maeda, Gasper; van der Wal, Jelle; Gupta, Arvind Kumar; Munissi, Joan J. E. et al.

Oxygenated Cyclohexene Derivatives and Other Constituents from the Roots of Monanthotaxis trichocarpa

Ingår i Journal of Natural Products, s. 210-215, 2020.

DOI Till DiVA

Phosphonamidates as potential NDM-1 inhibitors

Palica, Katarzyna

Till DiVA

Poongavanam, Vasanthanathan; Atilaw, Yoseph; Ye, Sofie; Ermondi, Giuseppe et al.

Predicting the permeability of macrocycles from conformational sampling – limitations of molecular flexibility

Ingår i Journal of Pharmaceutical Sciences, s. 301-313, 2020.

Till DiVA

Atilaw, Yoseph; Muiva-Mutisya, Lois; Bogaerts, Jonathan; Duffy, Sandra et al.

Prenylated Flavonoids from the Roots of Tephrosia rhodesica

Ingår i Journal of Natural Products, s. 2390-2398, 2020.

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Kumar, Rajnish; Kumar, Amit; Nordberg, Agneta; Långström, Bengt et al.

Proton pump inhibitors act with unprecedented potencies as inhibitors of the acetylcholine biosynthesizing enzyme - A plausible missing link for their association with incidence of dementia

Ingår i Alzheimer's & Dementia, s. 1031-1042, 2020.

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Källman, Erik; Delcey, Mickael G; Guo, Meiyuan; Lindh, Roland et al.

Quantifying similarity for spectra with a large number of overlapping transitions: Examples from soft X-ray spectroscopy

Ingår i Chemical Physics, 2020.

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Yannacone, Seth F.; Sethio, Daniel; Kraka, Elfi

Quantitative assessment of intramolecular hydrogen bonds in neutral histidine

Ingår i Theoretical Chemistry accounts, 2020.

DOI Till DiVA

Raggi, Gerardo; Fernández Galván, Ignacio; Ritterhoff, Christian L.; Vacher, Morgane et al.

Restricted-Variance Molecular Geometry Optimization Based on Gradient-Enhanced Kriging

Ingår i Journal of Chemical Theory and Computation, s. 3989-4001, 2020.

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Zandi, Linda; Makungu, Marco; Munissi, Joan J. E.; Duffy, Sandra et al.

Secoiridoids and Iridoids from Morinda asteroscepa

Ingår i Journal of Natural Products, s. 2641-2646, 2020.

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Källman, Erik; Guo, Meiyuan; Delcey, Mickael G; Meyer, Drew A. et al.

Simulations of valence excited states in coordination complexes reached through hard X-ray scattering

Ingår i Physical Chemistry, Chemical Physics - PCCP, s. 8325-8335, 2020.

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Ermondi, Giuseppe; Poongavanam, Vasanthanathan; Vallaro, Maura; Kihlberg, Jan et al.

Solubility prediction in the bRo5 chemical space: where are we right now?

Ingår i ADMET and DMPK, s. 207-214, 2020.

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Danelius, Emma; Poongavanam, Vasanthanathan; Peintner, Stefan; Wieske, Lianne H. E. et al.

Solution Conformations Explain the Chameleonic Behaviour of Macrocyclic Drugs

Ingår i Chemistry - A European Journal, s. 5231-5244, 2020.

DOI Till DiVA

Reiersolmoen, Ann Christin; Battaglia, Stefano; Oien-Odegaard, Sigurd; Kumar Gupta, Arvind et al.

Symmetry of three-center, four-electron bonds

Ingår i Chemical Science, s. 7979-7990, 2020.

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Kamerlin, Natasha; Delcey, Mickael G; Lindh, Roland

Unravelling the mechanism of pH-regulation in dinoflagellate luciferase

Ingår i International Journal of Biological Macromolecules, s. 2671-2680, 2020.

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Dickman, Rachael; Danelius, Emma; Mitchell, Serena A.; Hansen, D. Flemming et al.

A Chemical Biology Approach to Understanding Molecular Recognition of Lipid II by Nisin(1-12): Synthesis and NMR Ensemble Analysis of Nisin(1-12) and Analogues

Ingår i Chemistry - A European Journal, s. 14572-14582, 2019.

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Nyandoro, Stephen S.; Maeda, Gasper; Munissi, Joan J. E.; Gruhonjic, Amra et al.

A New Benzopyranyl Cadenane Sesquiterpene and Other Antiplasmodial and Cytotoxic Metabolites from Cleistochlamys kirkii

Ingår i Molecules, 2019.

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Chu, Dinh-Toi; Nguyet, Nguyen Thi Minh; Nga, Vu Thi; Lien, Nguyen Vu Thai et al.

An update on obesity: Mental consequences and psychological interventions

Ingår i Diabetes & Metabolic syndrome, s. 155-160, 2019.

DOI Till DiVA

Devaraj, Karthik; Ingner, Fredric; Sollert, Carina; Gates, Paul J. et al.

Arynes and Their Precursors from Arylboronic Acids via Catalytic C-H Silylation

Ingår i Journal of Organic Chemistry, s. 5863-5871, 2019.

DOI Till DiVA

Al-Smadi, Derar; Enugala, Thilak Reddy; Kessler, Vadim; Mhasal, Anil Rhanu et al.

Chemical and Biochemical Approaches for the Synthesis of Substituted Dihydroxybutanones and Di-, and Tri-Hydroxypentanones

Ingår i Journal of Organic Chemistry, s. 6982-6991, 2019.

DOI Till DiVA

Umereweneza, Daniel; Muhizi, Theoneste; Kamizikunze, Theoneste; Nkurunziza, Jean Pierre

Chemical Composition and Antifungal Activity of Essential Oils Extracted from Leaves of Eucalyptus Melliodora and Eucalyptus Anceps Grown in Rwanda

Ingår i Journal of Essential Oil-Bearing Plants (JEOBP), s. 151-158, 2019.

DOI Till DiVA

Peng, Cheng; Atilaw, Yoseph; Wang, Jinan; Xu, Zhijian et al.

Conformation of the Macrocyclic Drug Lorlatinib in Polar and Nonpolar Environments: A MD Simulation and NMR Study

Ingår i ACS Omega, s. 22245-22250, 2019.

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Hribersek, Matic

Control of Aryne Capture Regioselectivity via Fluoroboronate-induced Distortion

Till DiVA

Sigtryggsson, Sigtryggur Bjarki

Design and Synthesis of Novel Small-Molecule Inhibitors of the Keap1-Nrf2 PPI

2019.

Uppladdad fulltext Till DiVA

Development of Novel Macrocyclic Inhibitors of Protein-Protein Interactions

Applied to the Keap1-Nrf2 Complex Begnini, Fabio

Till DiVA

Olsson, Sandra K.; Benito Perez, Oscar; Blom, Magnus; Gogoll, Adolf

Effect of Ring Size on Photoisomerization Properties of Stiff Stilbene macrocycles

Ingår i Beilstein Journal of Organic Chemistry, s. 2408-2418, 2019.

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Zhou, Yang; Zou, Rongfeng; Kuang, Guanglin; Långström, Bengt et al.

Enhanced Sampling Simulations of Ligand Unbinding Kinetics Controlled by Protein Conformational Changes

Ingår i Journal of Chemical Information and Modeling, s. 3910-3918, 2019.

DOI Till DiVA

Norrehed, Sara; Karlsson, Christoffer; Light, Mark E.; Thapper, Anders et al.

Formation of persistent organic diradicals from N,N'-diphenyl-3,7- diazacyclooctanes

Ingår i Monatshefte fuer Chemie, s. 77-84, 2019.

DOI Till DiVA

Zou, Rongfeng; Kuang, Guanglin; Ågren, Hans; Nordberg, Agneta et al.

Free Energy Profile for Penetration of Pittsburgh Compound-B into the Amyloid β Fibril

Ingår i ACS Chemical Neuroscience, s. 1783-1790, 2019.

DOI Till DiVA

Vanderkooy, Alan; Gupta, Arvind Kumar; Foldes, Tamas; Lindblad, Sofia et al.

Halogen Bonding Helicates Encompassing Iodonium Cations

Ingår i Angewandte Chemie International Edition, s. 9012-9016, 2019.

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Caron, Giulia; Kihlberg, Jan; Ermondi, Giuseppe

Intramolecular hydrogen bonding: An opportunity for improved design in medicinal chemistry

Ingår i Medicinal research reviews (Print), s. 1707-1729, 2019.

DOI Till DiVA

Reiersolmoen, Ann Christin; Csokas, Daniel; Papai, Imre; Fiksdahl, Anne et al.

Mechanism of Au(III)-Mediated Alkoxycyclization of a 1,6-Enyne

Ingår i Journal of the American Chemical Society, s. 18221-18229, 2019.

DOI Till DiVA

Bergman, Hilde-Marlene; Lindfors, Lina; Palm, Fredrik; Kihlberg, Jan et al.

Metabolite aberrations in early diabetes detected in rat kidney using mass spectrometry imaging

Ingår i Analytical and Bioanalytical Chemistry, s. 2809-2816, 2019.

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Jiang, Xiangyi; Yu, Ji; Zhou, Zhongxia; Kongsted, Jacob et al.

Molecular design opportunities presented by solvent-exposed regions of target proteins

Ingår i Medicinal research reviews (Print), s. 2194-2238, 2019.

DOI Till DiVA

Fernández Galván, Ignacio; Vacher, Morgane; Alavi, Ali; Angeli, Celestino et al.

OpenMolcas: From Source Code to Insight

Ingår i Journal of Chemical Theory and Computation, s. 5925-5964, 2019.

DOI Till DiVA

Wu, Gaochan; Zhao, Tong; Kang, Dongwei; Zhang, Jian et al.

Overview of Recent Strategic Advances in Medicinal Chemistry

Ingår i Journal of Medicinal Chemistry, s. 9375-9414, 2019.

DOI Till DiVA

Khamesian, Marjan; Fernández Galván, Ignacio; Delcey, Mickael G; Sørensen, Lasse Kragh et al.

Spectroscopy of linear and circular polarized ligth with the exact semiclassical light–matter interaction

Ingår i Annual Reports in Computational Chemistry: Volume 15, s. 39-76, 2019.

DOI Till DiVA

Ingner, Fredric

Sustainable methods for the preparation of diverse Au(I) complexes

Till DiVA

Tai, Thai Duy Phuoc; Ngoan, Le Hoang; Thanh, Le Thanh; Vo, Duc Duy et al.

Synthesis of new 1,2,3-triazole derivatives from vanillin and beta-naphthol

Ingår i VIETNAM JOURNAL OF CHEMISTRY, s. 116-120, 2019.

DOI Till DiVA

Erdélyi, Máté

The three-center halogen bond

2019.

Till DiVA

Kalepu, Jagadeesh; Pilarski, Lukasz T.

Weinreb Amides as Directing Groups for Transition Metal-Catalyzed C-H Functionalizations

Ingår i Molecules, 2019.

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Tong, Dongmei; Lönnblom, Erik; Yau, Anthony C. Y.; Nandakumar, Kutty Selva et al.

A Shared Epitope of Collagen Type XI and Type II Is Recognized by Pathogenic Antibodies in Mice and Human with Arthritis

Ingår i Frontiers in Immunology, 2018.

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