国家/地区 India（8） Iran（7）
关键词 DENSITY FUNCTIONAL .（6） DFT（5） GRAPHENE OXIDE（5）
GRAPHENE（4） MOLECULAR DYNAMICS .（3） CORONENE（2）
MOLECULAR DYNAMIC（2） NANOCLUSTER（2） NANOCOMPOSITE（2）
SERS（2） SPECTROSCOPY（2） TRIAZOLE（2）
出版物 JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS（19）
出版时间 2020（4） 2022（4） 2015（2） 2018（2）
机构 UNIV BIRJAND（4） FATIMA MATA .（2）
作者 MARY YS（4） RAISSI H（4） ALOTAIBI JS（2） SHAHABI M（2）

Biophysical binding profile with ct-DNA and cytotoxic studies of a modulated nanoconjugate of umbelliferone cobalt oxide loaded on graphene oxide (GO) as drug carrier

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

YOUSUF S, ARJMAND F, SIDDIQUE HR, ALI MS, ALLOHEDAN HA, TABASSUM S

Understanding reactivity of a triazole derivative and its interaction with graphene and doped/undoped-coronene-a DFT study

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

MARY YS, MARY YS, ARMAKOVIC S, ARMAKOVIC SJ, NARAYANA B

Synthesis of exfoliated multilayer graphene and its putative interactions with SARS-CoV-2 virus investigated through computational studies

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

RAVAL B, SRIVASTAV AK, GUPTA SK, KUMAR U, MAHAPATRA SK, GAJJAR PN, BANERJEE I

Adsorption of Polyadenylic acid on graphene oxide: experiments and computer modeling

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

KARACHEVTSEV MV, STEPANIAN SG, VALEEV VA, LYTVYN OS, ADAMOWICZ L, KARACHEVTSEV VA

Structural study of letrozole and metronidazole and formation of self-assembly with graphene and fullerene with the enhancement of physical, chemical and biological activities

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

ALMUQRIN AH, ALOTAIBI JS, MARY YS, MARY YS, THOMAS R

Interaction of synthesized nitrogen enriched graphene quantum dots with novel anti-Alzheimer's drugs: spectroscopic insights

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

SHARMA S, SINGH N, NEPOVIMOVA E, KORABECNY J, KUCA K, SATNAMI ML, GHOSH KK

Potential of graphene oxide as a drug delivery system for Sumatriptan: a detailed density functional theory study

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

JAFARI Z, BAHARFAR R, RAD AS, ASGHARI S

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

Molecular interactions of MnO2@RGO (manganese dioxide-reduced graphene oxide) nanocomposites with bovine serum albumin

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

BARAL A, SATISH L, DAS DP, SAHOO H, GHOSH MK

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