国家/地区 India（4） Korea（2）
关键词 SERS（9）
出版物 POLYCYCLIC AROMATIC.（3） JOURNAL OF BIOMOLEC.（2）
出版时间 2022（3） 2023（2）
机构 FATIMA MATA .（2）
作者 MARY YS（9）

Modeling the Conformational Preference, Spectral Analysis and Other Quantum Mechanical Studies on Three Bioactive Aminobenzoate Derivatives and Their SERS Active Graphene Complexes

POLYCYCLIC AROMATIC COMPOUNDS

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

DFT and molecular docking studies of self-assembly of sulfone analogues and graphene

JOURNAL OF MOLECULAR MODELING

ALOTAIBI JS, ALMUQRIN AH, MARY YS, MARY YS, VAN ALSENOY C

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

Adsorption of Phenothiazine Derivatives on Graphene - DFT, Docking and MD Simulation

POLYCYCLIC AROMATIC COMPOUNDS

MARY YS, MARY YS

Adsorption of Pyrimidin-2-amine (PA) on Graphene Quantum Dots (GQDs): Non-covalent Interaction Study

JOURNAL OF MOLECULAR LIQUIDS

ULLAH Z, KIM HJ, MARY YS, ZHAN X, KWON HW

Quantum Mechanical Investigation into the Adsorption Pattern of Clomipramine and Methotrimeprazine HCl with Graphene and Fullerene

POLYCYCLIC AROMATIC COMPOUNDS

ALOTAIBI JS, MARY YS, MARY YS, ACHARJEE N

Theoretical model study of adsorbed antimalarial-graphene dimers: doping effects, photophysical parameters, intermolecular interactions, edge adsorption, and SERS

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS

ULLAH Z, SONAWANE PM, MARY YS, MARY YS, MANE P, CHAKRABORTY B, CHURCHILL DG

DFT computational study towards investigating psychotropic drugs, promazine and trifluoperazine adsorption on graphene, fullerene and carbon cyclic ring nanoclusters

SPECTROCHIMICA ACTA PART AMOLECULAR BIOMOLECULAR SPECTROSCOPY

ALMUQRIN AH, ALOTAIBI JS, MARY YS, MARY YS

Cluster formation between an oxadiazole derivative with metal nanoclusters (Ag/Au/Cu), graphene quantum dot sheets, SERS studies, and solvent effects

STRUCTURAL CHEMISTRY

ALOTAIBI JS, MARY YS, MARY YS, TRIVEDI R, CHAKRABORY B, THOMAS R