@article{CTT100904047, author = {Ryo Nakayama and Ryota Shimizu and Taishi Haga and Takefumi Kimura and Yasunobu Ando and Shigeru Kobayashi and Nobuaki Yasuo and Masakazu Sekijima and Taro Hitosugi}, title = {Tuning of Bayesian optimization for materials synthesis: simulation of the one-dimensional case}, journal = {Science and Technology of Advanced Materials: Methods}, year = 2022, } @article{CTT100904048, author = {Nurkanto Arif and Riyo Imamura and Yulia Rahmawati and Erwahyuni Endang Prabandari and Danang Waluyo and Takeshi Annoura and Kazuki Yamamoto and Masakazu Sekijima and Yuki Nishimura and Takayoshi Okabe and Tomoo Shiba and Norio Shibata and Hirotatsu Kojima and James Duffy and Tomoyoshi Nozaki}, title = {Dephospho-Coenzyme A Kinase Is an Exploitable Drug Target against Plasmodium falciparum: Identification of Selective Inhibitors by High-Throughput Screening of a Large Chemical Compound Library}, journal = {Antimicrobial Agents and Chemotherapy}, year = 2022, } @article{CTT100904085, author = {Junya Tabata and Takashi Nakaoku and Mitsugu Araki and Ryunosuke Yoshino and Shinji Kohsaka and Ayaka Otsuka and Masachika Ikegami and Ayako Ui and Shin-ichiro Kanno and Keiko Miyoshi and Shigeyuki Matsumoto and yukari sagae and Akira Yasui and Masakazu Sekijima and Hiroyuki Mano and Yasushi Okuno and Aikou Okamoto and Takashi Kohno}, title = {Novel Calcium-Binding Ablating Mutations Induce Constitutive RET Activity and Drive Tumorigenesis}, journal = {Cancer Research}, year = 2022, } @article{CTT100904086, author = {Kazuki Takeda and Kosuke Manago and Ayuko Morita and Yusuke K. Kawai and Nobuaki Yasuo and Masakazu Sekijima and Yoshinori Ikenaka and Takuma Hashimoto and Ryuichi Minato and Yusuke Oyamada and Kazuo Horikoshi and Hajime Suzuki and Mayumi Ishizuka and Shouta M.M. Nakayama}, title = {Toxicokinetic analysis of the anticoagulant rodenticides warfarin & diphacinone in Egyptian fruit bats (Rousettus aegyptiacus) as a comparative sensitivity assessment for Bonin fruit bats (Pteropus pselaphon)}, journal = {Ecotoxicology and Environmental Safety}, year = 2022, } @article{CTT100904088, author = {R Prabakaran and Puneet Rawat and Nobuaki Yasuo and Masakazu Sekijima and Sandeep Kumar and Gromiha Michael}, title = {Effect of charged mutation on aggregation of a pentapeptide: Insights from molecular dynamics simulations}, journal = {Proteins: Structure, Function, and Bioinformatics}, year = 2022, } @article{CTT100904050, author = {Takayuki Kimura and Nobuaki Yasuo and Masakazu Sekijima and Brooke Lustig}, title = {Statistical potentials for RNA-protein interactions optimized by CMA-ES}, journal = {Journal of Molecular Graphics and Modelling}, year = 2022, } @article{CTT100904049, author = {Kazuki Z Yamamoto and NOBUAKI YASUO and Masakazu Sekijima}, title = {Screening for Inhibitors of Main Protease in SARS-CoV-2: In Silico and In Vitro Approach Avoiding Peptidyl Secondary Amides}, journal = {Journal of Chemical Information and Modeling}, year = 2022, } @inproceedings{CTT100904083, author = {Mami Ozawa and Nobuaki Yasuo and Masakazu Sekijima}, title = {An Improved Model for Predicting Compound Retrosynthesizability Using Machine Learning}, booktitle = {2022 IEEE 22nd International Conference on Bioinformatics and Bioengineering (BIBE)}, year = 2022, } @inproceedings{CTT100869007, author = {Hayato Fujita and Akihiro Nomura and Toshio Endo and Masakazu Sekijima}, title = {タンパク質立体構造予測システム AlphaFold の TSUBAME3.0 上での高速化}, booktitle = {情報処理学会研究報告}, year = 2022, } @misc{CTT100840043, author = {Masakazu Sekijima and Hiroshi Yoda and Nobuaki Yasuo}, title = {立体構造判定装置、立体構造判定方法、立体構造の判別器学習装置、立体構造の判別器学習方法及びプログラム}, howpublished = {RegisteredPatent}, year = 2022, month = {}, note = {特願2019-015086(2019/01/31), 特開2020-123189(2020/08/13), 特許第7168979号(2022/11/01)} }