- 专利标题： METHODS AND APPARATUSES FOR GENERATING A DIGITAL REPRESENTATION OF CHEMICAL SUBSTANCES, MEASURING PHYSICOCHEMICAL PROPERTIES AND GENERATING CONTROL DATA FOR SYNTHESIZING CHEMICAL SUBSTANCES
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申请号： EP22216755.3申请日： 2022-12-27
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公开(公告)号： EP4394780A1公开(公告)日： 2024-07-03
- 发明人: Bina, Ali , Niederle, Astrid , Smarason, Sigurdur Vidir , Koltzenburg, Sebastian , Kahle, Klaus , Settels, Wolker , Wang, Ning , Gonzales Maldonado, Sandra , Eldred, Rosona
- 申请人： BASF SE
- 申请人地址： DE 67056 Ludwigshafen am Rhein Carl-Bosch-Strasse 38
- 专利权人： BASF SE
- 当前专利权人： BASF SE
- 当前专利权人地址： DE 67056 Ludwigshafen am Rhein Carl-Bosch-Strasse 38
- 代理机构： Horn Kleimann Waitzhofer Schmid-Dreyer Patent- und Rechtsanwälte PartG mbB
- 主分类号： G16C20/10
- IPC分类号： G16C20/10 ; G16C20/20 ; G16C20/40 ; G16C20/70 ; G06N3/0455
摘要：
A method for generating a compressed digital representation of a chemical substance, in particular polymers, includes the steps of receiving (S12) input data being a multimodal representation (2, 12) of a physicochemical property of the chemical substance and indicative of a measurable physicochemical property of the chemical substance; encoding (S13) said input data (2, 12) using a data driven compression model (3, 10) of the chemical substance for generating encoded substance data as a function of the received input data (2, 12); and generating chemical substance data indicative of the measurable physicochemical property of the chemical substance by decoding said encoded substance data using the data driven compression model (3, 10).
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