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H

Hiroaki Iwata

Tottori University

19H-index
58Paper Count
1.3KCitation Count
Published Papers 26
Publication Date
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Deep learning-based prediction of drug bitterness using molecular structures
errEuropean Journal of Pharmaceutical Sciences
IF4.7
err2026-07-01
err0
errOAAI
errIwata, Hiroaki; Tanihata, Soyoka; Fujiwara, Shin-ichi
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Toward clinical reliability: Visualizing and interpreting ai-based classification in peripheral blood smear analysis
errMachine Learning with Applications
IF4.9
err2025-12-01
err0
errOAAI
errIwata, Hiroaki; Shibayama, Tsukie; Watanabe, Miku; Shimohiro, Hisashi
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Improving ADME Prediction with Multitask Graph Neural Networks and Assessing Explainability in Lead Optimization
errJournal of Chemical Information and Modeling
IF5.3
err2025-10-22
err0
errOAAI
errShoma Ito; Takuto Koyama; Shigeyuki Matsumoto; Ryosuke Kojima; Yuji Okamoto; Masataka Kuroda; Hitoshi Kawashima; Reiko Watanabe; Tomoki Yonezawa; Takaaki Sumiyoshi; Kazuyoshi Ikeda; Kenji Mizuguchi; Hiroaki Iwata; Yasushi Okuno
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errSave
Image-based estimation of component ratios in pharmaceutical powders using optical microscopy and deep learning
errJournal of Drug Delivery Science and Technology
IF4.9
err2025-10-19
err0
errOAAI
errHiroaki Iwata; Shungo Kumada; Yoshihiro Hayashi
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errSave
Interpretable Multitask Deep Learning Models for Odor Perception Based on Molecular Structure
errCurrent Research in Food Science
IF7
err2025-10-08
err0
errOAAI
errHiroaki Iwata
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errSave
Machine Learning Prediction and Validation of Plasma Concentration-Time Profiles
errMOLECULAR PHARMACEUTICS
IF4.5
err2025-05-09
err0
PREAI
errIwata, Hiroaki; Kageyama, Michiharu; Handa, Koichi
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Clinical characteristics and outcomes of dipeptidyl peptidase-4 inhibitor-associated bullous pemphigoid patients: A retrospective study
errJOURNAL OF THE AMERICAN ACADEMY OF DERMATOLOGY
IF11.8
err2025-03-01
err0
PREAI
errUjiie, Inkin; Katayama, Sho; Mai, Yosuke; Mai, Shoko; Yoshimoto, Norihiro; Muramatsu, Ken; Iwata, Hiroaki; Izumi, Kentaro; Ujiie, Hideyuki
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kMoL: an open-source machine and federated learning library for drug discovery
errJOURNAL OF CHEMINFORMATICS
IF5.7
err2025-02-25
err0
errOAAI
errCozac, Romeo; Hasic, Haris; Choong, Jun Jin; Richard, Vincent; Beheshti, Loic; Froehlich, Cyrille; Koyama, Takuto; Matsumoto, Shigeyuki; Kojima, Ryosuke; Iwata, Hiroaki; Hasegawa, Aki; Otsuka, Takao; Okuno, Yasushi
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errSave
AI-driven prediction of bitterness and sweetness and analysis of receptor interactions
errCurrent Research in Food Science
IF7
err2025-01-01
err0
errOAAI
errHiroaki Iwata
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errSave
Accelerating virtual patient generation with a Bayesian optimization and machine learning surrogate model
errCPT-PHARMACOMETRICS & SYSTEMS PHARMACOLOGY
IF3
err2024-12-04
err0
PREAI
errIwata, Hiroaki; Saito, Ryuta
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Feature extraction of particle morphologies of pharmaceutical excipients from scanning electron microscope images using convolutional neural networks
errINTERNATIONAL JOURNAL OF PHARMACEUTICS
IF5.2
err2024-03-01
err2
errOAAI
errIwata, Hiroaki; Hayashi, Yoshihiro; Koyama, Takuto; Hasegawa, Aki; Ohgi, Kosuke; Kobayashi, Ippei; Okuno, Yasushi
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VGAE-MCTS: A New Molecular Generative Model Combining the Variational Graph Auto-Encoder and Monte Carlo Tree Search
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2023-11-22
err5
errOAAI
errIwata, Hiroaki; Nakai, Taichi; Koyama, Takuto; Matsumoto, Shigeyuki; Kojima, Ryosuke; Okuno, Yasushi
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Improving Compound-Protein Interaction Prediction by Self-Training with Augmenting Negative Samples
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2023-07-17
err2
errOAAI
errKoyama, Takuto; Matsumoto, Shigeyuki; Iwata, Hiroaki; Kojima, Ryosuke; Okuno, Yasushi
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Predicting Total Drug Clearance and Volumes of Distribution Using the Machine Learning-Mediated Multimodal Method through the Imputation of Various Nonclinical Data
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2022-08-22
err25
errOAAI
errIwata, Hiroaki; Matsuo, Tatsuru; Mamada, Hideaki; Motomura, Takahisa; Matsushita, Mayumi; Fujiwara, Takeshi; Maeda, Kazuya; Handa, Koichi
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Structure-Based de Novo Molecular Generator Combined with Artificial Intelligence and Docking Simulations
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2021-07-09
err37
PREAI
errMa, Biao; Terayama, Kei; Matsumoto, Shigeyuki; Isaka, Yuta; Sasakura, Yoko; Iwata, Hiroaki; Araki, Mitsugu; Okuno, Yasushi
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errSave
Prediction of Total Drug Clearance in Humans Using Animal Data: Proposal of a Multimodal Learning Method Based on Deep Learning
errJOURNAL OF PHARMACEUTICAL SCIENCES
IF3.8
err2021-04-01
err20
errOAAI
errIwata, Hiroaki; Matsuo, Tatsuru; Mamada, Hideaki; Motomura, Takahisa; Matsushita, Mayumi; Fujiwara, Takeshi; Kazuya, Maeda; Handa, Koichi
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Hydrophobic interactions at subsite S1′ of human dipeptidyl peptidase IV contribute significantly to the inhibitory effect of tripeptides
errHELIYON
IF3.6
err2020-06-01
err15
errOAAI
errAraki, Mitsugu; Kanegawa, Norimasa; Iwata, Hiroaki; Sagae, Yukari; Ito, Keisuke; Masuda, Katsuyoshi; Okuno, Yasushi
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kGCN: a graph-based deep learning framework for chemical structures
errJOURNAL OF CHEMINFORMATICS
IF5.7
err2020-05-12
err67
errOAAI
errKojima, Ryosuke; Ishida, Shoichi; Ohta, Masateru; Iwata, Hiroaki; Honma, Teruki; Okuno, Yasushi
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errSave
Improving the Accuracy of Protein-Ligand Binding Mode Prediction Using a Molecular Dynamics-Based Pocket Generation Approach
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2018-12-04
err8
PREAI
errAraki, Mitsugu; Iwata, Hiroaki; Ma, Biao; Fujita, Atsuto; Terayama, Kei; Sagae, Yukari; Ono, Fumie; Tsuda, Koji; Kamiya, Narutoshi; Okuno, Yasushi
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Elucidating the modes of action for bioactive compounds in a cell-specific manner by large-scale chemically-induced transcriptomics
errSCIENTIFIC REPORTS
IF3.9
err2017-01-10
err42
errOAAI
errIwata, Michio; Sawada, Ryusuke; Iwata, Hiroaki; Kotera, Masaaki; Yamanishi, Yoshihiro
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Research Directions

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Co-authors
Cooperation Journals
D
David J. Miller
H-index: 69 · Papers: 322
Y
Yutaka Satou
H-index: 62 · Papers: 205
V
Vincent Richard
H-index: 62 · Papers: 496
O
Osamu Nishimura
H-index: 59 · Papers: 435
K
Koji Tsuda
H-index: 55 · Papers: 410
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