Andreas Luttens

Publications
Public outreach and news

Articles

Journal article: NATURE COMMUNICATIONS. 2025;16(1):1741
Virtual fragment screening for DNA repair inhibitors in vast chemical space.
Luttens A; Vo DD; Scaletti ER; Wiita E; Almlöf I; Wallner O; Davies J; Košenina S; Meng L; Long M; Mortusewicz O; Masuyer G; Ballante F; Michel M; Homan E; Scobie M; Kalderén C; Warpman Berglund U; Tarnovskiy AV; Radchenko DS; Moroz YS; Kihlberg J; Stenmark P; Helleday T; Carlsson J
Journal article: CURRENT OPINION IN STRUCTURAL BIOLOGY. 2024;87:102829
Structure-based virtual screening of vast chemical space as a starting point for drug discovery.
Carlsson J; Luttens A
Journal article: JOURNAL OF MEDICINAL CHEMISTRY. 2022;65(4):3473-3517
Importance of Binding Site Hydration and Flexibility Revealed When Optimizing a Macrocyclic Inhibitor of the Keap1-Nrf2 Protein-Protein Interaction.
Begnini F; Geschwindner S; Johansson P; Wissler L; Lewis RJ; Danelius E; Luttens A; Matricon P; Carlsson J; Lenders S; König B; Friedel A; Sjö P; Schiesser S; Kihlberg J
Journal article: JOURNAL OF THE AMERICAN CHEMICAL SOCIETY. 2022;144(7):2905-2920
Ultralarge Virtual Screening Identifies SARS-CoV-2 Main Protease Inhibitors with Broad-Spectrum Activity against Coronaviruses
Luttens A; Gullberg H; Abdurakhmanov E; Duy DV; Akaberi D; Talibov VO; Nekhotiaeva N; Vangeel L; De Jonghe S; Jochmans D; Krambrich J; Tas A; Lundgren B; Gravenfors Y; Craig AJ; Atilaw Y; Sandstrom A; Moodie LWK; Lundkvist A; van Hemert MJ; Neyts J; Lennerstrand J; Kihlberg J; Sandberg K; Danielson UH; Carlsson J
Journal article: NATURE PROTOCOLS. 2022;17(1):177
Publisher Correction: A practical guide to large-scale docking.
Bender BJ; Gahbauer S; Luttens A; Lyu J; Webb CM; Stein RM; Fink EA; Balius TE; Carlsson J; Irwin JJ; Shoichet BK
Journal article: NATURE PROTOCOLS. 2021;16(10):4799-4832
A practical guide to large-scale docking.
Bender BJ; Gahbauer S; Luttens A; Lyu J; Webb CM; Stein RM; Fink EA; Balius TE; Carlsson J; Irwin JJ; Shoichet BK
Journal article: JOURNAL OF MEDICINAL CHEMISTRY. 2020;63(2):613-620
Docking Finds GPCR Ligands in Dark Chemical Matter
Ballante F; Rudling A; Zeifman A; Luttens A; Duy DV; Irwin JJ; Kihlberg J; Brea J; Isabel Loza M; Carlsson J

All other publications

Preprint: CHEMRXIV. 2023
Rapid Traversal of Ultralarge Chemical Space using Machine Learning Guided Docking Screens
Luttens A; Cabeza de Vaca I; Sparring L; Norinder U; Carlsson J

Articles

All other publications

News from KI

Events from KI