Akhil Kumar

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Elucidation and Synthetic Design of Biochemical Pathways using novoStoic

Akhil Kumar, 2017 .

Assessing the Metabolic Impact of Nitrogen Availability Using a Compartmentalized Maize Leaf Genome-Scale Model1[C][W][OPEN]

Margaret N. Simons, C. Maranas, G. Mouille, 2014, Plant Physiology.

Molecular docking based virtual screening of natural compounds as potential BACE1 inhibitors: 3D QSAR pharmacophore mapping and molecular dynamics analysis

Ashok Sharma, Akhil Kumar, Sudeep Roy, 2016, Journal of biomolecular structure & dynamics.

Docking, molecular dynamics, binding energy-MM-PBSA studies of naphthofuran derivatives to identify potential dual inhibitors against BACE-1 and GSK-3β

Gaurava Srivastava, Ashok Sharma, A. Negi, 2019, Journal of biomolecular structure & dynamics.

Virtual screening, ADMET profiling, molecular docking and dynamics approaches to search for potent selective natural molecules based inhibitors against metallothionein-III to study Alzheimer's disease.

M. Masařík, I. Provazník, Akhil Kumar, 2015, Methods.

Investigation of naphthofuran moiety as potential dual inhibitor against BACE-1 and GSK-3β: molecular dynamics simulations, binding energy, and network analysis to identify first-in-class dual inhibitors against Alzheimer’s disease

Gaurava Srivastava, Ashok Sharma, A. Negi, 2017, Journal of Molecular Modeling.

CANNABIS A REVIEW AND ITS THERAPEUTIC POTENTIALS

Rachana, Manisha Singh, Akhil Kumar, 2016 .

Physicochemical Characterization, Molecular Docking, and In Vitro Dissolution of Glimepiride–Captisol Inclusion Complexes

Sabu Thomas, Akhil Kumar, Sudeep Roy, 2020, ACS omega.

Current Trends in Docking Methodologies

Ashok Sharma, Akhil Kumar, Shubhandra Tripathi, 2016 .

A non-canonical autophagy-dependent role of the ATG16L1T300A variant in urothelial vesicular trafficking and uropathogenic Escherichia coli persistence

R. Xavier, Hao-Wei Chang, I. Mysorekar, 2018, Autophagy.

The Flavonoid Derivative 2-(4′ Benzyloxyphenyl)-3-hydroxy-chromen-4-one Protects Against Aβ42-Induced Neurodegeneration in Transgenic Drosophila: Insights from In Silico and In Vivo Studies

S. Singh, Akhil Kumar, Roshan Fatima, 2014, Neurotoxicity Research.

Structural investigations into the binding mode of novel neolignans Cmp10 and Cmp19 microtubule stabilizers by in silico molecular docking, molecular dynamics, and binding free energy calculations

Ashok Sharma, A. Negi, Akhil Kumar, 2016, Journal of biomolecular structure & dynamics.

Beneficial plant product, their uses and their evolutionary perspectives: A review

A. Sharma, Akhil Kumar, 2018 .

SARS-CoV-2 Pocketome: Severe Acute Respiratory Syndrome Coronavirus 2, Pockets Identification for Antiviral & Antimicrobial Phytomolecules and Drug Repurposing

Akhil Kumar, A. K. Shasany, 2020 .

Changing Paradigm from one Target one Ligand Towards Multi-target Directed Ligand Design for Key Drug Targets of Alzheimer Disease: An Important Role of In Silico Methods in Multi-target Directed Ligands Design

Akhil Kumar, Ashish Tiwari, Ashok Sharma, 2018, Current neuropharmacology.

In vitro Micropropagation of Calla lily: An Overview

Akhil Kumar, 2020 .

In vitro propagation and phyto-chemical assessment of Cymbidium aloifolium (L.) Sw.: An orchid of pharma-horticultural importance

Dinesh Kumar, Akhil Kumar, B. Bhargava, 2022, South African Journal of Botany.

Gallic acid-based indanone derivative interacts synergistically with tetracycline by inhibiting efflux pump in multidrug resistant E. coli

Ashok Sharma, D. Chanda, A. Negi, 2015, Applied Microbiology and Biotechnology.

Study on Osmotic Dehydration of Fig Fruit (Ficus carica) Slices Mediated Tray Drying

Akhil Kumar, T. Niranjan, G. Rajender, 2018, International Journal of Current Microbiology and Applied Sciences.

Enzymatic Treatment of Man-made Cellulosic Fabrics

Akhil Kumar, C. Purtell, Marjo Lepola, 1994 .

QUANTIFICATION OF NOVEL DPP4 INHIBITOR CHROMATOGRAPHIC TECHNIQUES: BRIEF REVIEW

Akhil Kumar, C. Sailaja, Y. Rao, 2019 .

Pathway design using de novo steps through uncharted biochemical spaces

Akhil Kumar, Lin Wang, Costas D. Maranas, 2018, Nature Communications.

Computational Modeling of Multi-target-Directed Inhibitors Against Alzheimer’s Disease

Akhil Kumar, Ashok Sharma, Ashok Sharma, 2018 .

A review on synthesis and various pharmacological aspects of Rhinacanthin-C with special emphasis on antidiabetic activity

Akhil Kumar, S. Sreesaila, Z. S. Pillai, 2021 .

The effect of Benzothiazolone‐2 on the expression of Metallothionein‐3 in modulating Alzheimer's disease

M. Masařík, I. Choi, J. Gumulec, 2017, Brain and behavior.

Development of a Knowledgebase ( MetRxn ) of Metabolites , Reactions and Atom Mappings to Accelerate Discovery and Redesign

Margaret N. Simons, Akhil Kumar, Saratram Gopalakrishnan, 2016 .

Virtual screening, ADMET profiling, molecular docking and dynamics approaches to search for potent selective natural molecule based inhibitors against metallothionein-III to study Alzheimer's disease

Akhil Kumar, Ivo Provaznik, Sudeep Roy, 2014, 2014 IEEE International Conference on Bioinformatics and Biomedicine (BIBM).

The Flavonoid Derivative 2-(4′ Benzyloxyphenyl)-3-hydroxy-chromen-4-one Protects Against Aβ42-Induced Neurodegeneration in Transgenic Drosophila: Insights from In Silico and In Vivo Studies

S. Singh, Akhil Kumar, Roshan Fatima, 2014, Neurotoxicity Research.

Molecular investigation of active binding site of isoniazid (INH) and insight into resistance mechanism of S315T-MtKatG in Mycobacterium tuberculosis.

Gaurava Srivastava, Ashok Sharma, Akhil Kumar, 2017, Tuberculosis.

Molecular insight into multiple RpoB clinical mutants of Mycobacterium tuberculosis: An attempt to probe structural variations in rifampicin binding site underlying drug resistance.

Gaurava Srivastava, Ashok Sharma, Akhil Kumar, 2018, International journal of biological macromolecules.

Molecular insight into amyloid oligomer destabilizing mechanism of flavonoid derivative 2-(4′ benzyloxyphenyl)-3-hydroxy-chromen-4-one through docking and molecular dynamics simulations

Ashok Sharma, S. Singh, Akhil Kumar, 2016, Journal of biomolecular structure & dynamics.

Molecular docking and simulation studies to give insight of surfactin amyloid interaction for destabilizing Alzheimer’s Aβ42 protofibrils

A. Verma, Akhil Kumar, M. Debnath, 2016, Medicinal Chemistry Research.

Pathway design using de novo steps through uncharted biochemical spaces

C. Maranas, C. Ng, Lin Wang, 2018, Nature Communications.

A physicochemical descriptor based method for effective and rapid screening of dual inhibitors against BACE-1 and GSK-3β as targets for Alzheimer's disease

Akhil Kumar, Ashok Sharma, Gaurava Srivastava, 2017, Comput. Biol. Chem..