Kairi Furui

12 papers C 1Journal 11

Year	Rank	Type	Title / Venue / Authors
2026	J	`jnl`	GraphBioisostere: general bioisostere prediction model with deep graph neural network. J. Supercomput. Sho Masunaga, Kairi Furui, Apakorn Kengkanna, Masahito Ohue
2026	J	`jnl`	PBPredictor.net: GBDT-based model and web tool for prediction of blood-placental barrier permeability of small molecules. J. Supercomput. Masahito Ohue, Kairi Furui
2025	J	`jnl`	ALLM-Ab: Active Learning-Driven Antibody Optimization Using Fine-Tuned Protein Language Models. J. Chem. Inf. Model. Kairi Furui, Masahito Ohue
2025	J	`jnl`	Boltzina: Efficient and Accurate Virtual Screening via Docking-Guided Binding Prediction with Boltz-2. CoRR Kairi Furui, Masahito Ohue
2025	J	`jnl`	NPGPT: natural product-like compound generation with GPT-based chemical language models. J. Supercomput. Koh Sakano, Kairi Furui, Masahito Ohue
2025	J	`jnl`	PairMap: An Intermediate Insertion Approach for Improving the Accuracy of Relative Free Energy Perturbation Calculations for Distant Compound Transformations. J. Chem. Inf. Model. Kairi Furui, Takafumi Shimizu, Yutaka Akiyama, S. Roy Kimura, Yoh Terada, Masahito Ohue
2024	J	`jnl`	Active learning for energy-based antibody optimization and enhanced screening. CoRR Kairi Furui, Masahito Ohue
2024	J	`jnl`	Fastlomap: faster lead optimization mapper algorithm for large-scale relative free energy perturbation. J. Supercomput. Kairi Furui, Masahito Ohue
2024	J	`jnl`	NPGPT: Natural Product-Like Compound Generation with GPT-based Chemical Language Models. CoRR Koh Sakano, Kairi Furui, Masahito Ohue
2023	J	`jnl`	Faster Lead Optimization Mapper Algorithm for Large-Scale Relative Free Energy Perturbation. CoRR Kairi Furui, Masahito Ohue
2022	C	`conf`	Compound Virtual Screening by Learning-to-Rank with Gradient Boosting Decision Tree and Enrichment-based Cumulative Gain. CIBCB Kairi Furui, Masahito Ohue
2022	J	`jnl`	Compound virtual screening by learning-to-rank with gradient boosting decision tree and enrichment-based cumulative gain. CoRR Kairi Furui, Masahito Ohue