{"title":"MPGVAE:利用信息传递神经网络改进小有机分子的生成","authors":"Daniel Flam-Shepherd, Tony C Wu, Alán Aspuru-Guzik","doi":"10.1088/2632-2153/ABF5B7","DOIUrl":null,"url":null,"abstract":"","PeriodicalId":18148,"journal":{"name":"Mach. Learn. Sci. Technol.","volume":"51 1","pages":"45010"},"PeriodicalIF":0.0000,"publicationDate":"2021-04-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"14","resultStr":"{\"title\":\"MPGVAE: improved generation of small organic molecules using message passing neural nets\",\"authors\":\"Daniel Flam-Shepherd, Tony C Wu, Alán Aspuru-Guzik\",\"doi\":\"10.1088/2632-2153/ABF5B7\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"\",\"PeriodicalId\":18148,\"journal\":{\"name\":\"Mach. Learn. Sci. Technol.\",\"volume\":\"51 1\",\"pages\":\"45010\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2021-04-07\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"14\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Mach. Learn. Sci. Technol.\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1088/2632-2153/ABF5B7\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Mach. Learn. Sci. Technol.","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1088/2632-2153/ABF5B7","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 14