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Enabling multi-target drug discovery through latent evolutionary optimization and synthesis-aware prioritization (EVOSYNTH) - Communications Chemistry
2+ hour, 54+ min ago (1161+ words) Ramsay, R. R., Popovic-Nikolic, M. R., Nikolic, K., Uliassi, E. & Bolognesi, M. L. A perspective on multi-target drug discovery and design for complex diseases. Clin. Transl. Med. 7, 3 (2018). Halli-Tierney, A. D., Scarbrough, C. & Carroll, D. Polypharmacy: evaluating risks and deprescribing. Am. Fam. Physician 100, 3238 (2019). Makhoba, X. H., Viegas Jr, C., Mosa, R. A., Viegas, F. P. & Pooe, O. J. Potential impact of the…...
A machine learning-based pharmacokinetics predictor (EGFR-PROPK) for EGFR-targeting PROTACs - Communications Chemistry
3+ hour, 14+ min ago (1287+ words) These authors contributed equally: Ran Zhang, Fenglei Li, Yao Liu. Yao Liu,Ya Geng&Li Zeng School of Life Science and Technology, ShanghaiTech University, Shanghai, China Shanghai Clinical Research and Trial Center, Shanghai, China R.Z. and F.L. constructed and trained the network…...
Real-time dynamic prediction of HFMD transmission using SEIRQ-ARIMA hybrid model optimized by multi-stage ABC-GWO algorithm - Scientific Reports
1+ day, 14+ hour ago (221+ words) We use essential cookies to make sure the site can function. We also use optional cookies for advertising, personalisation of content, usage analysis, and social media, as well as to allow video information to be shared for both marketing, analytics…...
Restoration of oracle bone inscriptions using a fast residual shrinkage denoising network with fractal gradient - npj Heritage Science
1+ day, 18+ hour ago (211+ words) Reconstructing a high-quality oracle bone image from its degraded counterpart transforms Eq. (1) into the following optimization problem: Subsequently, the split Bregman algorithm is employed to obtain the data fidelity term and the regularization constraint term. Equation (3) is solved through an…...
An improved semantic and sketch biconditional guided image inpainting model for Chinese landscape painting - npj Heritage Science
2+ day, 12+ hour ago (1656+ words) We use essential cookies to make sure the site can function. We also use optional cookies for advertising, personalisation of content, usage analysis, and social media, as well as to allow video information to be shared for both marketing, analytics…...
Bridging modalities with AI: a review of AI advances in multimodal biomedical imaging - Communications Engineering
2+ day, 19+ hour ago (1658+ words) We use essential cookies to make sure the site can function. We also use optional cookies for advertising, personalisation of content, usage analysis, and social media, as well as to allow video information to be shared for both marketing, analytics…...
Matters Arising: Near-identical images, not foundation models, explain purported re-identification of patients from medical imaging - npj Digital Medicine
2+ day, 21+ hour ago (363+ words) Example retinal image pairs from GRAPE, where finding the most similar image using RETFound features retrieved an image from the same patient (a) and a different patient (b), respectively; c illustrates a fundus image at normal resolution (top) and a resolution of…...
The role of large language models in emergency care: a comprehensive benchmarking study - npj Artificial Intelligence
3+ day, 12+ hour ago (1043+ words) We use essential cookies to make sure the site can function. We also use optional cookies for advertising, personalisation of content, usage analysis, and social media, as well as to allow video information to be shared for both marketing, analytics…...
A geometric foundation model for enzyme retrieval with evolutionary insights - Nature Catalysis
3+ day, 21+ hour ago (1450+ words) Nature Catalysis (2026)Cite this article Breaker, R. R. DNA enzymes. Nat. Biotechnol. 15, 427431 (1997). Knowles, J. R. Enzyme catalysis: not different, just better. Nature 350, 121124 (1991). Khosla, C. & Harbury, P. B. Modular enzymes. Nature 409, 247252 (2001). Chen, Y. & Li, F. Metabolomes evolve faster than metabolic network structures. Proc. Natl Acad. Sci. USA 121, e2400519121 (2024). Kraut, J. How do…...
Mapping noise to synthesis recipes with a generative diffusion model - Nature Computational Science
3+ day, 23+ hour ago (196+ words) We use essential cookies to make sure the site can function. We also use optional cookies for advertising, personalisation of content, usage analysis, and social media, as well as to allow video information to be shared for both marketing, analytics…...