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Physical Chemistry

Exciton Transfer Simulations in LH2 Accelerated by Machine-Learned Hamiltonians Reveal Transient Delocalization Mechanism

David Sebastian Hoffmann, Philipp Dohmen, Monja Sokolov, Ulrich Kleinekathöfer, Marcus Elstner

Biological and Medicinal Chemistry

Semisynthesis of aged histone H4 reveals robustness and vulnerability of chromatin towards molecular "wear-and-tear"

Tianze Zhang, Luis Guerra, Yana Berlina, Jon Wilson, Beat Fierz, Manuel Müller

Biological and Medicinal Chemistry

Translocation of cell-penetrating peptides involving calcium-dependent interactions between anionic glycosaminoglycans and phosphocholine bilayer

Bingwei HE, Sonia KHEMAISSA, Sébastien CARDON, Rodrigue Marquant, Françoise ILLIEN, Delphine RAVAULT, Fabienne BURLINA, Emmanuelle SACHON, Astrid WALRANT, Sandrine SAGAN

Inorganic Chemistry

ELECTRUM: An Electron Configuration-based Universal Metal Fingerprint for Transition Metal Compounds

Angelo Frei, Markus Orsi

Theoretical and Computational Chemistry

Enumeration Approach to Atom-to-Atom Mapping Accelerated by Ising Computing

Mohammad Ali, Yuta Mizuno, Seiji Akiyama, Yuuya Nagata, Tamiki Komatsuzaki

Inorganic Chemistry

Frameworks Construction with Rhodium-Organic Cuboctahedra via Rigid Linker Incorporation

Yu-Shan Lin, Javier Lopez-Cabrelles, Chia-Her Lin, Shuhei Furukawa

Theoretical and Computational Chemistry

Targeting RNA with Small Molecules using State-of-the-Art Methods Provides Highly Predictive Affinities of Riboswitch Inhibitors

Narjes Ansari, Chengwen Liu, Florent Hedin, Jérôme Hénin, Jay W. Ponder, Pengyu Ren, Jean-Philip Piquemal, Louis Lagardère, Krystel El Hage

Materials Chemistry

Multi-stimuli-responsive porous organic polymers for syn-ergistic drug-gas anticancer therapy

Tina Skorjanc, David Burke, Tomoko Inose, Shuhei Furukawa

Biological and Medicinal Chemistry

Microbe Engineering of Drimane-type Building Blocks for Chiral Pool Synthesis of Meroterpenoids

Wenyu Du, Zhongyu Cheng, Xingming Pan, Chenhao Liu, Mingyu Yue, Tianhao Li, Zhixi Xiao, Lu-Lu Li, Xuelan Zeng, Xiaoxu Lin, Fuzhuo Li, Liao-Bin Dong

Biological and Medicinal Chemistry

Structure-signal relationships of the δ-opioid-receptor (DOR)-selective agonist KNT-127 - Part I: Impact of the morphinan skeleton on the G-protein-biased DOR agonism

Keita Kajino, Tomoya Sugai, Ryoji Kise, Riko Suzuki, Akihisa Tokuda, Yuki Sekiya, Tomoya Kakumoto, Risako Katamoto, Noriki Kutsumura, Yasuyuki Nagumo, Asuka Inoue, Tsuyoshi Saitoh

Inorganic Chemistry

Thermal properties of binary chlorides relevant to molten salt chemistry

Alex Pixler, Colleen Kennedy, Aaron Unger, Vitaliy Goncharov, Jeremy Jones, Paul Andersen, Cory Windorff

Organic Chemistry

Inverting Conventional Chemoselectivity of Metal Carbenes with Sulfenylcarbenes for Late-Stage Functionalizations

Prakash Kafle, Deacon Herndon, Indrajeet Sharma

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