JP2024537793A5 - - Google Patents

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Publication number
JP2024537793A5
JP2024537793A5 JP2024519522A JP2024519522A JP2024537793A5 JP 2024537793 A5 JP2024537793 A5 JP 2024537793A5 JP 2024519522 A JP2024519522 A JP 2024519522A JP 2024519522 A JP2024519522 A JP 2024519522A JP 2024537793 A5 JP2024537793 A5 JP 2024537793A5
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training
score
model
compound
positive
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JP2024519522A
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Japanese (ja)
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JP2024537793A (ja
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Priority claimed from PCT/US2022/045250 external-priority patent/WO2023055949A1/en
Publication of JP2024537793A publication Critical patent/JP2024537793A/ja
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JP2024519522A 2021-10-01 2022-09-29 負のポーズデータ及びモデルコンディショニングを使用した化合物とポリマーとの間の相互作用の特徴付け Pending JP2024537793A (ja)

Applications Claiming Priority (3)

Application Number Priority Date Filing Date Title
US202163251142P 2021-10-01 2021-10-01
US63/251,142 2021-10-01
PCT/US2022/045250 WO2023055949A1 (en) 2021-10-01 2022-09-29 Characterization of interactions between compounds and polymers using negative pose data and model conditioning

Publications (2)

Publication Number Publication Date
JP2024537793A JP2024537793A (ja) 2024-10-16
JP2024537793A5 true JP2024537793A5 (https=) 2025-10-03

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JP2024519522A Pending JP2024537793A (ja) 2021-10-01 2022-09-29 負のポーズデータ及びモデルコンディショニングを使用した化合物とポリマーとの間の相互作用の特徴付け

Country Status (4)

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US (1) US20240395364A1 (https=)
EP (1) EP4409579A1 (https=)
JP (1) JP2024537793A (https=)
WO (1) WO2023055949A1 (https=)

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* Cited by examiner, † Cited by third party
Publication number Priority date Publication date Assignee Title
CN119343678A (zh) * 2022-04-29 2025-01-21 艾腾怀斯股份有限公司 使用姿态系综的化合物与聚合物之间相互作用的表征
CN119920302A (zh) * 2024-12-17 2025-05-02 哈尔滨工业大学 一种利用邻域信息和加权融合网络的药物重定位方法
CN120196962B (zh) * 2025-05-22 2025-07-25 武汉理工大学三亚科教创新园 一种中草药-基因关联关系预测方法、系统及存储介质

Family Cites Families (3)

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US9373059B1 (en) 2014-05-05 2016-06-21 Atomwise Inc. Systems and methods for applying a convolutional network to spatial data
EP3356999B1 (en) * 2015-10-04 2019-11-27 Atomwise Inc. System for applying a convolutional network to spatial data
US10546237B2 (en) 2017-03-30 2020-01-28 Atomwise Inc. Systems and methods for correcting error in a first classifier by evaluating classifier output in parallel

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