Results 241 to 250 of about 22,157,959 (291)

Practical Computational Exploration of Chemical Reaction Space: Assessing the Chemical Stability of Active Pharmaceutical Ingredients Under Acidic Conditions

open access: yesAngewandte Chemie, EarlyView.
Metadynamics simulations drive automated reaction exploration of acid‐catalysed drug degradation, generating a network spanning 1720 species and 2471 elementary steps. QM‐based filtering reduces the network to eight candidate pathways for rigorous DFT refinement and microkinetic modelling.
Julius Seumer   +5 more
wiley   +1 more source

Photoactivated Platinum Complexes: Targeting Membrane Proteins and Organelles for Precision Cancer Therapy

open access: yesAngewandte Chemie, EarlyView.
This review highlights an emerging anticancer approach integrating platinum agents into photodynamic therapy (PDT) and photoactivated chemotherapy (PACT) systems, further augmented by cancer cell membrane‐ and organelle‐targeting. By directing photoactivated platinum complexes from nontargeted distribution to cancer cells or defined subcellular sites ...
Shu Chen   +3 more
wiley   +1 more source

Anomaly detection as a tool for identifying cases of interest in postmortem toxicology. [PDF]

open access: yesSci Rep
Söderberg C   +4 more
europepmc   +1 more source

Multiple forensic insights for human identification using single teeth with applicability to advanced postmortem remains. [PDF]

open access: yesSci Rep
Yamada S   +13 more
europepmc   +1 more source

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