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Computational Investigation of Deoxyribose and Phosphate Substitutions Effects on the Hydrogen Bond Strength of Adenine–Thymine Base Pair in the Gas Phase and Water Solution

Russian Journal of Physical Chemistry A, 2022-12, Vol.96 (14), p.3290-3302

2022

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On the performance of molecular tailoring approach for estimation of the intramolecular hydrogen bond energies of RAHB systems: a comparative study

Structural chemistry, 2020-02, Vol.31 (1), p.423-433

2020

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Ab initio study of aerogen-bonds between some heterocyclic compounds of benzene with the noble gas elements (Ne, Ar, and Kr)

Structural chemistry, 2020-02, Vol.31 (1), p.435-445

2020

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Presentation of the simple and accurate models for estimating the individual hydrogen bond energies of Watson–Crick base pairs

Structural chemistry, 2023-02, Vol.34 (1), p.153-163

2023

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Evaluating the web‐application resiliency to business‐layer DoS attacks

ETRI Journal, 2020, 42(3), , pp.433-445

2020

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Metamorphosis of prostate specific membrane antigen (PSMA) inhibitors

Biophysical reviews, 2022-02, Vol.14 (1), p.303-315

2022

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Evaluating the web-application resiliency to business-layer DoS attacks

ETRI journal, 2020-06, Vol.42 (3), p.433-445

2020

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The Inhibitory Effects of the Herbals Secondary Metabolites (7α-acetoxyroyleanone, Curzerene, Incensole, Harmaline, and Cannabidiol) on COVID-19: A Molecular Docking Study

Recent patents on biotechnology, 2024, Vol.18 (4), p.316

2024

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Boron nitride nanotubes for delivery of 5-fluorouracil as anticancer drug: a theoretical study

Applied surface science, 2018-01, Vol.428, p.500-513

2018

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Study of tyramine-binding mechanism and insecticidal activity of oil extracted from Eucalyptus against Sitophilus oryzae

Frontiers in chemistry, 2022-09, Vol.10, p.964700-964700

2022

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A Crisis Situations Decision-Making Systems Software Development Process With Rescue Experiences

IEEE access, 2020, Vol.8, p.59599-59617

2020

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Comparative study of resonance-inhibited hydrogen bonded (RIHB) systems with different atoms involved: the leading role of σ-planarity

Molecular physics, 2019-07, Vol.117 (14), p.1871-1881

2019

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On the performance of resonance assisted hydrogen bond theory in malonaldehyde derivatives

Computational and theoretical chemistry, 2016-11, Vol.1096, p.27-32

2016

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Semantic web Racer: Dynamic security testing of the web application against race condition in the business layer

Expert systems with applications, 2022-06, Vol.195, p.116569, Article 116569

2022

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The first principle study of chalcogen bonds, pnicogen bond and their mutual effects in a set of complexes between the triazine with SHF and PH2F ligands

Computational and theoretical chemistry, 2022-10, Vol.1216, p.113867, Article 113867

2022

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Computational investigation on the intramolecular resonance-inhibited hydrogen bonding: a new type of interaction versus the RAHB model

Theoretical chemistry accounts, 2015-07, Vol.134 (7), Article 82

2015

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Solvent effects on the molecular stability, intramolecular hydrogen bond, and π-electron delocalization in the simple RAHB systems with different donors and acceptors: a quantum chemical study

Structural chemistry, 2019-06, Vol.30 (3), p.777-785

2019

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Study on the interaction of metallocene catalysts with the surface of carbon nanotubes and its influence on the catalytic properties. 1. Investigation of possible complex structures and the influence on structural and electronic properties

Journal of organometallic chemistry, 2016-09, Vol.818, p.154-162

2016

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A comprehensive theoretical study of conformational analysis, intramolecular hydrogen bond, π-electron delocalization, and tautomeric preferences in 2-selenoformyl-3-thioxo-propionaldehyde

Structural chemistry, 2018-08, Vol.29 (4), p.1057-1065

2018

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A New Intrusion Detection System Using the Improved Dendritic Cell Algorithm

Computer journal, 2021-08, Vol.64 (8), p.1193-1214

2021

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Business-layer client-side racer: dynamic security testing of the web application against client-side race condition in the business layer

International journal of information security, 2023-08, Vol.22 (4), p.1029-1054

2023

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A novel sophisticated hybrid method for intrusion detection using the artificial immune system

Journal of information security and applications, 2021-05, Vol.58, p.102721, Article 102721

2021

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Comparative study of NH···O and NH···S intramolecular hydrogen bonds in β-aminoacrolein, β-thioaminoacrolein and their halogenated derivatives by some usual methods

Structural chemistry, 2017-06, Vol.28 (3), p.587-596

2017

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Molecular structure and vibrational assignment of (trifluoroacetyl) acetone: A density functional study

Journal of molecular structure, 2006-04, Vol.787 (1), p.148-162

2006

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The first singlet excited state (S1) intramolecular hydrogen bond of malonaldehyde derivatives: a TD-DFT and CIS study

Structural chemistry, 2016-12, Vol.27 (6), p.1769-1780

2016

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Computational Investigation of Deoxyribose and Phosphate Substitutions Effects on the Hydrogen Bond Strength of Adenine–Thymine Base Pair in the Gas Phase and Water Solution

On the performance of molecular tailoring approach for estimation of the intramolecular hydrogen bond energies of RAHB systems: a comparative study

Ab initio study of aerogen-bonds between some heterocyclic compounds of benzene with the noble gas elements (Ne, Ar, and Kr)

Presentation of the simple and accurate models for estimating the individual hydrogen bond energies of Watson–Crick base pairs

Evaluating the web‐application resiliency to business‐layer DoS attacks

Metamorphosis of prostate specific membrane antigen (PSMA) inhibitors

Evaluating the web-application resiliency to business-layer DoS attacks

The Inhibitory Effects of the Herbals Secondary Metabolites (7α-acetoxyroyleanone, Curzerene, Incensole, Harmaline, and Cannabidiol) on COVID-19: A Molecular Docking Study

Boron nitride nanotubes for delivery of 5-fluorouracil as anticancer drug: a theoretical study

Study of tyramine-binding mechanism and insecticidal activity of oil extracted from Eucalyptus against Sitophilus oryzae

A Crisis Situations Decision-Making Systems Software Development Process With Rescue Experiences

Comparative study of resonance-inhibited hydrogen bonded (RIHB) systems with different atoms involved: the leading role of σ-planarity

On the performance of resonance assisted hydrogen bond theory in malonaldehyde derivatives

Semantic web Racer: Dynamic security testing of the web application against race condition in the business layer

The first principle study of chalcogen bonds, pnicogen bond and their mutual effects in a set of complexes between the triazine with SHF and PH2F ligands

Computational investigation on the intramolecular resonance-inhibited hydrogen bonding: a new type of interaction versus the RAHB model

Solvent effects on the molecular stability, intramolecular hydrogen bond, and π-electron delocalization in the simple RAHB systems with different donors and acceptors: a quantum chemical study

Study on the interaction of metallocene catalysts with the surface of carbon nanotubes and its influence on the catalytic properties. 1. Investigation of possible complex structures and the influence on structural and electronic properties

A comprehensive theoretical study of conformational analysis, intramolecular hydrogen bond, π-electron delocalization, and tautomeric preferences in 2-selenoformyl-3-thioxo-propionaldehyde

A New Intrusion Detection System Using the Improved Dendritic Cell Algorithm

Business-layer client-side racer: dynamic security testing of the web application against client-side race condition in the business layer

A novel sophisticated hybrid method for intrusion detection using the artificial immune system

Comparative study of NH···O and NH···S intramolecular hydrogen bonds in β-aminoacrolein, β-thioaminoacrolein and their halogenated derivatives by some usual methods

Molecular structure and vibrational assignment of (trifluoroacetyl) acetone: A density functional study

The first singlet excited state (S1) intramolecular hydrogen bond of malonaldehyde derivatives: a TD-DFT and CIS study

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