国家/地区 Iran（5）
关键词 DENSITY FUNCTIONAL THEORY（5）
出版物 JOURNAL OF BIOMOLEC.（3）
出版时间 2020（3）
机构 UNIV BIRJAND（5）
作者 RAISSI H（5） HASANZADE Z（2） HASHEMZADEH .（2）

Theoretical elucidation of the amino acid interaction with graphene and functionalized graphene nanosheets: insights from DFT calculation and MD simulation

AMINO ACIDS

KAMEL M, RAISSI H, HASHEMZADEH H, MOHAMMADIFARD K

Understanding co-loading of doxorubicin and camptothecin on graphene and folic acid-conjugated graphene for targeting drug delivery: classical MD simulation and DFT calculation

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

ALINEJAD A, RAISSI H, HASHEMZADEH H

Assessment of the chitosan-functionalized graphene oxide as a carrier for loading thioguanine, an antitumor drug and effect of urea on adsorption process: Combination of DFT computational and molecular dynamics simulation studies

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

HASANZADE Z, RAISSI H

Theoretical investigation insights into the temperature triggered tegafur anticancer drug release from the surface of graphene oxide nanosheet

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

SHAHABI M, RAISSI H

Solvent/co-solvent effects on the electronic properties and adsorption mechanism of anticancer drug Thioguanine on Graphene oxide surface as a nanocarrier: Density functional theory investigation and a molecular dynamics

APPLIED SURFACE SCIENCE

HASANZADE Z, RAISSI H