34th IUPAP Conference on Computational Physics（CCP2023）
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Session Details

Contributed talks (Chemical physics/Biophysics/Softmatter physics)Chemical physics/Biophysics/Softmatter physics

Parallel session 1

Tue. Aug 8, 2023 11:30 AM - 12:10 PM JST
Tue. Aug 8, 2023 2:30 AM - 3:10 AM UTC
301 (Room 2) 3F
Chair: Ayori Mitsutake (Meiji University)
11:30 AM - 11:50 AM JST(2:30 AM - 2:50 AM UTC)

[C08-1-01]Nonequilibrium molecular dynamics simulation for amyloid-fibril dissociation

*Hisashi Okumura1,2,3, Satoru G. Itoh1,2,3 (1. Exploratory Research Center on Life and Living Systems (Japan), 2. Institute for Molecular Science (Japan), 3. SOKENDAI (Japan))
On-demand video
11:50 AM - 12:10 PM JST(2:50 AM - 3:10 AM UTC)

[C08-1-02]Explaining of reaction coordinates in complex molecular systems using deep learning and XAI: Application to alanine dipeptide isomerization

*Kang Kim1, Takuma Kikutsuji1, Yusuke Mori1, Kei-ichi Okazaki2, Toshifumi Mori3, Nobuyuki Matubayasi1 (1. Osaka University (Japan), 2. Institute for Molecular Science (Japan), 3. Kyushu University (Japan))
On-demand video
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