[HTML][HTML] AI for managing open innovation: Opportunities, challenges, and a research agenda

T Broekhuizen, H Dekker, P de Faria, S Firk… - Journal of Business …, 2023 - Elsevier
Artificial intelligence (AI) provides ample opportunities for enabling effective knowledge
sharing among organizations seeking to foster open innovation. Past research often …

Innovative robotic technologies and artificial intelligence in pharmacy and medicine: paving the way for the future of health care—a review

M Stasevych, V Zvarych - Big Data and Cognitive Computing, 2023 - mdpi.com
The future of innovative robotic technologies and artificial intelligence (AI) in pharmacy and
medicine is promising, with the potential to revolutionize various aspects of health care …

ZINC-22─ A free multi-billion-scale database of tangible compounds for ligand discovery

BI Tingle, KG Tang, M Castanon… - Journal of chemical …, 2023 - ACS Publications
Purchasable chemical space has grown rapidly into the tens of billions of molecules,
providing unprecedented opportunities for ligand discovery but straining the tools that might …

From traditional ethnopharmacology to modern natural drug discovery: A methodology discussion and specific examples

S Pirintsos, A Panagiotopoulos, M Bariotakis… - Molecules, 2022 - mdpi.com
Ethnopharmacology, through the description of the beneficial effects of plants, has provided
an early framework for the therapeutic use of natural compounds. Natural products, either in …

Artificial intelligence revolutionizing drug development: Exploring opportunities and challenges

PC Tiwari, R Pal, MJ Chaudhary… - Drug Development …, 2023 - Wiley Online Library
By harnessing artificial intelligence (AI) algorithms and machine learning techniques, the
entire drug discovery process stands to undergo a profound transformation, offering a …

GPCNDTA: prediction of drug-target binding affinity through cross-attention networks augmented with graph features and pharmacophores

L Zhang, CC Wang, Y Zhang, X Chen - Computers in Biology and Medicine, 2023 - Elsevier
Drug-target affinity prediction is a challenging task in drug discovery. The latest
computational models have limitations in mining edge information in molecule graphs …

[HTML][HTML] Drug repurposing: An effective strategy to accelerate contemporary drug discovery

P Zhan, B Yu, L Ouyang - Drug discovery today, 2022 - ncbi.nlm.nih.gov
Because of the high risk, substantial cost and slow pace of new drug discovery and
development, drug repurposing (also called repositioning, redirecting, reprofiling) is …

DockOpt: A tool for automatic optimization of docking models

IS Knight, O Mailhot, KG Tang… - Journal of Chemical …, 2024 - ACS Publications
Molecular docking is a widely used technique for leveraging protein structure for ligand
discovery, but it remains difficult to utilize due to limitations that have not been adequately …

ComplexEye: a multi-lens array microscope for high-throughput embedded immune cell migration analysis

Z Cibir, J Hassel, J Sonneck, L Kowitz, A Beer… - Nature …, 2023 - nature.com
Autonomous migration is essential for the function of immune cells such as neutrophils and
plays an important role in numerous diseases. The ability to routinely measure or target it …

Pharmacological chaperones and protein conformational diseases: approaches of computational structural biology

D Grasso, S Galderisi, A Santucci, A Bernini - International Journal of …, 2023 - mdpi.com
Whenever a protein fails to fold into its native structure, a profound detrimental effect is likely
to occur, and a disease is often developed. Protein conformational disorders arise when …