{"title":"基于分子动力学草图的自闭症谱系疾病抑制因子结构设计","authors":"Bipin Nair, V. Bhaskaran, K. Arunjit","doi":"10.5138/09750215.1973","DOIUrl":null,"url":null,"abstract":"In this paper we are sketching the chemical structure of suppressor drug for autism spectrum disorder using a computational tool. Here we are designing three molecular compounds like Fluoxetine, Risperidone, Melatonin. Structuring the suppressors, sketching the aromatization and bonding of the functional groups with the elements like Oxygen, Nitrogen, halogens. In our work we are using computational algorithm for drawing the structure of suppressor drug. In this paper we are mentioning the autism spectrum suppressor’s molecular formula as well as structural formula.","PeriodicalId":13912,"journal":{"name":"International Journal of Drug Delivery","volume":"15 1","pages":"142-146"},"PeriodicalIF":0.0000,"publicationDate":"2017-02-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"2","resultStr":"{\"title\":\"Structural designing of suppressors for autisms spectrum diseases using molecular dynamics sketch\",\"authors\":\"Bipin Nair, V. Bhaskaran, K. Arunjit\",\"doi\":\"10.5138/09750215.1973\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"In this paper we are sketching the chemical structure of suppressor drug for autism spectrum disorder using a computational tool. Here we are designing three molecular compounds like Fluoxetine, Risperidone, Melatonin. Structuring the suppressors, sketching the aromatization and bonding of the functional groups with the elements like Oxygen, Nitrogen, halogens. In our work we are using computational algorithm for drawing the structure of suppressor drug. In this paper we are mentioning the autism spectrum suppressor’s molecular formula as well as structural formula.\",\"PeriodicalId\":13912,\"journal\":{\"name\":\"International Journal of Drug Delivery\",\"volume\":\"15 1\",\"pages\":\"142-146\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2017-02-28\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"2\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"International Journal of Drug Delivery\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.5138/09750215.1973\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"International Journal of Drug Delivery","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.5138/09750215.1973","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Structural designing of suppressors for autisms spectrum diseases using molecular dynamics sketch
In this paper we are sketching the chemical structure of suppressor drug for autism spectrum disorder using a computational tool. Here we are designing three molecular compounds like Fluoxetine, Risperidone, Melatonin. Structuring the suppressors, sketching the aromatization and bonding of the functional groups with the elements like Oxygen, Nitrogen, halogens. In our work we are using computational algorithm for drawing the structure of suppressor drug. In this paper we are mentioning the autism spectrum suppressor’s molecular formula as well as structural formula.