{"id":4819,"date":"2023-08-30T10:42:51","date_gmt":"2023-08-30T10:42:51","guid":{"rendered":"https:\/\/dailyai.com\/?p=4819"},"modified":"2023-08-30T10:42:51","modified_gmt":"2023-08-30T10:42:51","slug":"ai-llm-learns-chemical-language-to-develop-new-polymers","status":"publish","type":"post","link":"https:\/\/dailyai.com\/pt\/2023\/08\/ai-llm-learns-chemical-language-to-develop-new-polymers\/","title":{"rendered":"A IA LLM aprende a linguagem qu\u00edmica para desenvolver novos pol\u00edmeros."},"content":{"rendered":"<p><strong>Investigadores do Georgia Tech desenvolveram um modelo de aprendizagem autom\u00e1tica que torna muito mais f\u00e1cil para os cientistas de materiais desenvolverem novos pol\u00edmeros.<\/strong><\/p>\n<p><span style=\"font-weight: 400;\">Os pol\u00edmeros s\u00e3o grandes mol\u00e9culas feitas de longas cadeias de blocos de constru\u00e7\u00e3o qu\u00edmica. Todos os dias utilizamos pol\u00edmeros sint\u00e9ticos como o nylon, o poli\u00e9ster ou embalagens de pl\u00e1stico.<\/span><\/p>\n<p><span style=\"font-weight: 400;\">Os cientistas de materiais tentam inventar novos arranjos de pol\u00edmeros para produzir materiais com propriedades espec\u00edficas. Se quisermos um material que seja leve, el\u00e1stico, imperme\u00e1vel e resistente ao calor, podemos criar um pol\u00edmero com todas essas propriedades.<\/span><\/p>\n<p><span style=\"font-weight: 400;\">O problema \u00e9 que descobrir qual a combina\u00e7\u00e3o de qu\u00edmicos que criaria um pol\u00edmero com essas propriedades \u00e9 uma tarefa enorme. H\u00e1 uma infinidade de combina\u00e7\u00f5es e \u00e9 extremamente dif\u00edcil prever as propriedades que um novo pol\u00edmero ter\u00e1.<\/span><\/p>\n<p><span style=\"font-weight: 400;\">O <\/span><a href=\"https:\/\/research.gatech.edu\/revolutionary-ai-algorithm-learns-chemical-language-and-accelerates-polymer-research\"><span style=\"font-weight: 400;\">Investigadores do Georgia Tech<\/span><\/a><span style=\"font-weight: 400;\"> treinaram o seu LLM, denominado polyBERT, num conjunto de dados de 80 milh\u00f5es de estruturas qu\u00edmicas de pol\u00edmeros. O resultado \u00e9 um modelo que compreende a linguagem dos produtos qu\u00edmicos.<\/span><\/p>\n<p><span style=\"font-weight: 400;\">Da mesma forma que os LLM s\u00e3o formados numa l\u00edngua como o ingl\u00eas, o polyBERT compreende agora a gram\u00e1tica e a sintaxe de como os qu\u00edmicos e os \u00e1tomos se combinam para criar pol\u00edmeros.<\/span><\/p>\n<p><span style=\"font-weight: 400;\">A National Science Foundation (NSF) financiou a investiga\u00e7\u00e3o por detr\u00e1s do polyBERT. A sua directora de programa, Debora Rodrigues, disse que os investigadores estavam \"a desenvolver uma nova ferramenta de intelig\u00eancia artificial para ultrapassar o desafio de determinar quais as combina\u00e7\u00f5es de produtos qu\u00edmicos que ir\u00e3o produzir os pol\u00edmeros mais eficazes\".<\/span><\/p>\n<p><span style=\"font-weight: 400;\">Ao utilizar o polyBERT, os cientistas de materiais podem trabalhar com combina\u00e7\u00f5es de produtos qu\u00edmicos mais de 100 vezes mais r\u00e1pido do que antes. O resultado da utiliza\u00e7\u00e3o do modelo \u00e9 um conjunto de dados que inclui 100 milh\u00f5es de pol\u00edmeros hipot\u00e9ticos e as suas previs\u00f5es para 29 propriedades.<\/span><\/p>\n<p><span style=\"font-weight: 400;\">Se for um cientista de materiais \u00e0 procura de um novo material com propriedades muito espec\u00edficas, n\u00e3o precisa de fazer experi\u00eancias e esperar pelo melhor, pode simplesmente consultar o conjunto de dados que a IA gerou.<\/span><\/p>\n<p><span style=\"font-weight: 400;\">Embora os investigadores tenham treinado o polyBERT em pol\u00edmeros, afirmaram que, teoricamente, tamb\u00e9m poderia ser utilizado para outras investiga\u00e7\u00f5es qu\u00edmicas.\u00a0<\/span><\/p>\n<p><span style=\"font-weight: 400;\">O potencial de cria\u00e7\u00e3o de materiais mais sustent\u00e1veis ou eficientes do ponto de vista energ\u00e9tico representa um benef\u00edcio imediato no mundo real da aplica\u00e7\u00e3o deste tipo de intelig\u00eancia artificial.<\/span><\/p>","protected":false},"excerpt":{"rendered":"<p>Os investigadores do Georgia Tech desenvolveram um modelo de aprendizagem autom\u00e1tica que torna muito mais f\u00e1cil para os cientistas de materiais desenvolver novos pol\u00edmeros. Os pol\u00edmeros s\u00e3o mol\u00e9culas grandes feitas de longas cadeias de blocos de constru\u00e7\u00e3o qu\u00edmica. Todos os dias utilizamos pol\u00edmeros sint\u00e9ticos como o nylon, o poli\u00e9ster ou embalagens de pl\u00e1stico. Os cientistas de materiais tentam encontrar novas combina\u00e7\u00f5es de pol\u00edmeros para produzir materiais com propriedades espec\u00edficas. Se quisermos um material que seja leve, el\u00e1stico, imperme\u00e1vel e resistente ao calor, podemos criar um pol\u00edmero com todas essas propriedades. O problema \u00e9 que descobrir qual a combina\u00e7\u00e3o de qu\u00edmicos que criaria um pol\u00edmero com todas essas propriedades<\/p>","protected":false},"author":6,"featured_media":4821,"comment_status":"closed","ping_status":"open","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[84],"tags":[150,107,207,105],"class_list":["post-4819","post","type-post","status-publish","format-standard","has-post-thumbnail","hentry","category-industry","tag-ai-benefits","tag-generative-ai","tag-llm","tag-machine-learning"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v27.4 - https:\/\/yoast.com\/product\/yoast-seo-wordpress\/ -->\n<title>AI LLM learns chemical language to develop new polymers. | DailyAI<\/title>\n<meta name=\"robots\" content=\"index, follow, max-snippet:-1, max-image-preview:large, max-video-preview:-1\" \/>\n<link rel=\"canonical\" href=\"https:\/\/dailyai.com\/pt\/2023\/08\/ai-llm-learns-chemical-language-to-develop-new-polymers\/\" \/>\n<meta property=\"og:locale\" content=\"pt_PT\" \/>\n<meta property=\"og:type\" content=\"article\" \/>\n<meta property=\"og:title\" content=\"AI LLM learns chemical language to develop new polymers. | DailyAI\" \/>\n<meta property=\"og:description\" content=\"Researchers at Georgia Tech have developed a machine-learning model that makes it a lot easier for materials scientists to develop new polymers. Polymers are large molecules made from long strings of chemical building blocks. We use synthetic polymers like Nylon, Polyester, or plastic packaging every day. Materials scientists try to come up with new arrangements of polymers to make materials that have specific properties. If you wanted a material that was lightweight, stretchy, waterproof, and heat resistant you could make a polymer that had all those properties. 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