The 146th Annual Meeting of the Pharmaceutical Society of Japan (Osaka)
Advanced Search

Session Details

Poster Presentation(B) Pharmaceutical Physics

[27-59-am]Informatics, Computational chemistry 1

Fri. Mar 27, 2026 9:30 AM - 11:30 AM JST
Fri. Mar 27, 2026 12:30 AM - 2:30 AM UTC
Room 59 (4001, Bldg. 4, Area 4 [B1F]) (1)
Discusser: Takeshi Ishikawa, Kitazawa Soichiro

[27-59-am-01]Docking simulation and molecular dynamics simulation study of inhibition mechanism of (+)-eupenoxide for α-glycosidase

○Mako Sato1, Shoji Maehara1, Toshiyuki Hata1 (1. Facul. Pharm. Pharm. Sci., Fukuyama Univ.)

[27-59-am-02S]Molecular dynamics simulation analysis of the molecular recognition mechanism of the BCL-2–selective inhibitor ABT-199

○Hazuki Akahori1, Hiroaki Saito1 (1. Faculty of Pharmaceutical Sciences,Hokuriku University)

[27-59-am-03S]Virtual Alanine Scan of the SARS-CoV-2 Papain-Like Protease in Complex with the Inhibitor VIR251

○Kafuka Nagasaka1, Ayato Mizuno1, Tomoki Nakayoshi1,2, Koichi Kato1,3, Akifumi Oda1 (1. Fac. Pharm., Meijo Univ., 2. Inst. Adv. Res., Nagoya Univ., 3. Fac. Pharm. Sci., Shonan Univ. Med. Sci.)

[27-59-am-04S]SARS-CoV-2 Drug Repurposing: Benchmarking Integrative Informatics and Network-Based Approaches Using Multi-Aspect Screening Data

○Toshiki Ohtomo1, Satoko Otsuguro2, Kageyama Itsuki 1, Kota Kodama1, Naoyoshi Maeda3, Koichi Watashi4, Makoto Takeda5, Hashiguchi Takao6, Hideo Fukuhara7, Yanai Shiori2, Takao Nomura2, Masahito Ohue8, Katsumi Maenaka2,7,9 (1. Sch. Pharm. Pharm. Sci., Hoshi Univ., 2. Fac. Pharm. Sci., Hokkaido Univ., 3. Health Sci. Univ. of Hokkaido, 4. JIHS, 5. Grad. Sch. Med. & Fac. Med., Univ. Tokyo, 6. Inst. Life & Med. Sci., Kyoto Univ., 7. Int. Inst. Zoonosis Control, Hokkaido Univ., 8. Sch. Computing, Inst. Sci. Tokyo, 9. Grad. Sch. Pharm. Sci. & Fac. Pharm. Sci., Kyushu Univ.)

[27-59-am-05S]Computational Analysis of Parviflorone Derivatives Targeting Syntenin-1 for Anti-Breast Cancer Activity

○Ayuna Ejiri1, Yohei Saito1, Masuo Goto2, Kyoko Goto1,2,3, Shuichi Fukuyoshi1 (1. Grad. Sch. Pharm. Sci., Kanazawa Univ., 2. Eshelman Sch. Pharm., Univ. N. Carolina, 3. WPI Nano Life Sci. Inst., Kanazawa Univ.)

[27-59-am-06S]Analyses of the effects of CYP2B6 gene polymorphisms on the enzymatic activities using the molecular dynamics simulations

○Saki Hibino1, Ayato Mizuno1, Tomoki Nakayoshi1,2, Masahiro Hiratsuka3,4, Koichi Kato1,5, Akifumi Oda1 (1. Fac. Pharm., Meijo Univ., 2. Inst. Adv. Res., Nagoya Univ., 3. Grad. Sch. Pharm. Sci., Tohoku Univ., 4. INGEM, Tohoku Univ., 5. Fac. Pharm. Sci., Shonan Univ. Med. Sci.)

[27-59-am-07]An In Silico study of Novel Geldanamycin Derivatives as Hsp90 Inhibitors for Cancer Therapy using Molecular Dynamics Simulation

○Jitnapa Sirirak1, Satipat Suttayasorranakhom1, Poomipat Tamdee1, Waya S. Phutdhawong1 (1. Department of Chemistry, Faculty of Science, Silpakorn University, Nakhon Pathom, 73000 Thailand)

[27-59-am-08S]The Investigation of Phase Inversion of Myristic Acid In Situ Gels for Drug Delivery Applications

○Poomipat Tamdee1, Napaphol Puyathorn2, Thawatchai Phaechamud3, Jitnapa Sirirak1 (1. Department of Chemistry, Faculty of Science, Silpakorn University, Nakhon Pathom, 73000 Thailand, 2. Department of Pharmaceutical Science, Faculty of Pharmacy, Chiang Mai University, Chiang Mai 50200 Thailand, 3. Department of Pharmaceutical Technology, Faculty of Pharmacy, Silpakorn University, Nakhon Pathom 73000 Thailand)

[27-59-am-09S]Effects of Site-Specific Aspartic Acid Stereoinversion on the Three-Dimensional Structure of Amyloid-β

○Masashi Aoki1, Ayato Mizuno1, Tomoki Nakayoshi1,2, Koichi Kato1,3, Akifumi Oda1 (1. Fac. Pharm., Meijo Univ., 2. Inst. Adv. Res., Nagoya Univ., 3. Fac. Pharm. Sci., Shonan Univ. Med. Sci.)

[27-59-am-10S]Molecular redesign and interaction energy analysis of glycan recognition in MytiLec-1

○Manaka Saito1, Yoonha Park1, Yuka Kanaya1, Tatsuya Kawasaki1, Yuki Fujii1, Tatsusada Yoshida1 (1. Fucl. Pharm. Sci., Nagasaki Int. Univ.)
Back to Category List