In silico molecular docking studies and MM/GBSA analysis of coumarin-carbonodithioate hybrid derivatives divulge the anticancer potential against breast cancer

In Silico Molecular Docking Studies on the Chemical Constituents of Clerodendrum phlomidis for its Cytotoxic Potential against Breast Cancer Markers

Research Journal of Pharmacy and Technology ◽

10.5958/0974-360x.2018.00300.1 ◽

2018 ◽

Vol 11 (4) ◽

pp. 1612

Author(s):

N. Habeela Jainab ◽

M. K. Mohan Maruga Raja

Keyword(s):

Breast Cancer ◽

Molecular Docking ◽

In Silico ◽

Chemical Constituents ◽

Docking Studies ◽

Cytotoxic Potential ◽

Cancer Markers ◽

Clerodendrum Phlomidis ◽

Novel Quinazolin-2,4-Dione Hybrid Molecules as Possible Inhibitors Against Malaria: Synthesis and in silico Molecular Docking Studies

Frontiers in Molecular Biosciences ◽

10.3389/fmolb.2020.00105 ◽

2020 ◽

Vol 7 ◽

Cited By ~ 2

Author(s):

Aboubakr Haredi Abdelmonsef ◽

Mahmoud Eldeeb Mohamed ◽

Mohamed El-Naggar ◽

Hussain Temairk ◽

Ahmed Mohamed Mosallam

Keyword(s):

Molecular Docking ◽

In Silico ◽

Docking Studies ◽

Hybrid Molecules ◽

Synthesis and characterization of cellulose/TiO2 nanocomposite: Evaluation of in vitro antibacterial and in silico molecular docking studies

Carbohydrate Polymers ◽

10.1016/j.carbpol.2020.116868 ◽

2020 ◽

Vol 249 ◽

pp. 116868

Author(s):

Arularasu M.V. ◽

M. Harb ◽

R. Sundaram

Keyword(s):

Molecular Docking ◽

In Silico ◽

Docking Studies ◽

Synthesis And Characterization ◽

Interaction of 5-(2, 4-dimethylbenzyl) pyrrolidin-2-one with selected antifungal drug target enzymes by in silico molecular docking studies

Interdisciplinary Sciences Computational Life Sciences ◽

10.1007/s12539-011-0098-1 ◽

2011 ◽

Vol 3 (3) ◽

pp. 198-203 ◽

Author(s):

Kumar Saurav ◽

K. Kannabiran

Keyword(s):

Molecular Docking ◽

In Silico ◽

Drug Target ◽

Docking Studies ◽

Antifungal Drug ◽

In silico molecular docking studies of new potential 4-phthalazinyl-hydrazones on selected Trypanosoma cruzi and Leishmania enzyme targets

Journal of Molecular Graphics and Modelling ◽

10.1016/j.jmgm.2017.07.013 ◽

2017 ◽

Vol 76 ◽

pp. 313-329 ◽

Cited By ~ 8

Author(s):

Angel H. Romero ◽

Simón E. López

Keyword(s):

Molecular Docking ◽

Trypanosoma Cruzi ◽

In Silico ◽

Docking Studies ◽

In silico Molecular Docking studies to investigate interactions of natural Camptothecin molecule with diabetic enzymes

Research Journal of Pharmacy and Technology ◽

10.5958/0974-360x.2017.00515.7 ◽

2017 ◽

Vol 10 (9) ◽

pp. 2917 ◽

Author(s):

Jeyabaskar Suganya ◽

T Viswanathan ◽

Mahendran Radha ◽

Nishandhini Marimuthu

Keyword(s):

Molecular Docking ◽

In Silico ◽

Docking Studies ◽

Medicinal Plants - International Journal of Phytomedicines and Related Industries ◽

GC-MS analysis and in silico molecular docking studies of anti-inflammatory compounds from Thottea barberi (Gamble) Ding Hou root

10.5958/0975-6892.2019.00037.6 ◽

2019 ◽

Vol 11 (3) ◽

pp. 286 ◽

Author(s):

Adna Jayaprakash ◽

Adheena Elza Johns ◽

Femy K. Haneef ◽

P.M. Radhamany

Keyword(s):

Molecular Docking ◽

In Silico ◽

Docking Studies ◽

Ms Analysis ◽

Anti Inflammatory ◽

Dermaseptin-Based Antiviral Peptides to Prevent COVID-19 through In Silico Molecular Docking Studies against SARS-CoV-2 Spike Protein

Pharmaceutical Sciences and Research ◽

10.7454/psr.v7i4.1079 ◽

2020 ◽

Vol 7 (4) ◽

pp. 65-70 ◽

Author(s):

Taufik Muhammad Fakih ◽

Keyword(s):

Molecular Docking ◽

In Silico ◽

Docking Studies ◽

Spike Protein ◽

Antiviral Peptides ◽

Evaluation of antidiabetic potential of flavonoid rich fraction of Hybanthus enneaspermum in diabetic rats: In-silico molecular docking studies for aldose reductase, α-glucosidase and α-amylase

Bone Reports ◽

10.1016/j.bonr.2020.100476 ◽

2020 ◽

Vol 13 ◽

pp. 100476

Author(s):

Dinesh Kumar Patel

Keyword(s):

Molecular Docking ◽

Aldose Reductase ◽

In Silico ◽

Docking Studies ◽

Diabetic Rats ◽

Molecular mechanism of interactions between chrysin and I-kappa-B kinase epsilon (IKKe)/tank binding kinase-1(TBK1): Cell-based assay and in silico molecular docking studies

Journal of Biomolecular Structure and Dynamics ◽

10.1080/07391102.2019.1581086 ◽

2019 ◽

Vol 38 (2) ◽

pp. 589-596

Author(s):

M. Amir Siddiqui ◽

Badruddeen ◽

Juber Akhtar ◽

Shahab Uddin M.S. ◽

Mohammad Irfan Khan ◽

...

Keyword(s):

Molecular Docking ◽

Molecular Mechanism ◽

In Silico ◽

Docking Studies ◽

I Kappa B Kinase ◽