Showing results (1-10 of 52) with videos related to
Sort By:
Pageof 6
Journal of Chemical Information and Modeling|October 22, 2025
ALLM-Ab: Active Learning-Driven Antibody Optimization Using Fine-Tuned Protein Language ModelsKairi Furui, Masahito OhueMolecular Informatics|August 10, 2026
PairMap2: A Web Application for Intermediate-Molecule Insertion in Relative Binding Free Energy CalculationsKairi Furui, Masahito OhueACS Omega|March 31, 2025
Benchmarking HelixFold3-Predicted Holo Structures for Relative Free Energy Perturbation CalculationsKairi Furui, Masahito OhueBiochemistry and Biophysics Reports|July 21, 2025
Leveraging AlphaFold2 structural space exploration for generating drug target structures in structure-based virtual screeningKeisuke Uchikawa, Kairi Furui, Masahito OhueAllergology International : Official Journal of the Japanese Society of Allergology|September 18, 2025
Predictive and therapeutic applications of protein language modelsKairi Furui, Koh Sakano, Masahito OhueNatural Product Reports|May 14, 2026
Chemical language models for natural product discoveryKoh Sakano, Kairi Furui, Apakorn Kengkanna, et al.Journal of Chemical Information and Modeling|January 13, 2025
PairMap: An Intermediate Insertion Approach for Improving the Accuracy of Relative Free Energy Perturbation Calculations for Distant Compound TransformationsKairi Furui, Takafumi Shimizu, Yutaka Akiyama, et al.BMC Research Notes|September 22, 2023
MEGADOCK-on-Colab: an easy-to-use protein-protein docking tool on Google ColaboratoryMasahito OhueCommunications Chemistry|November 17, 2023
Variational autoencoder-based chemical latent space for large molecular structures with 3D complexityToshiki Ochiai, Tensei Inukai, Manato Akiyama, et al.Biophysics and Physicobiology|September 3, 2025
Protein-ligand affinity prediction via Jensen-Shannon divergence of molecular dynamics simulation trajectoriesKodai Igarashi, Masahito OhuePageof 6