SlideShare a Scribd company logo
Protein/DNAProtein/DNAProtein/DNAProtein/DNA –––– LigandLigandLigandLigand
InteractionInteractionInteractionInteraction
Dr. Prashantha Karunakar
Assistant Professor
Department of Biotechnology
100 Feet Ring Road, Banashankari 3rd Stage
PES University
Bangalore - 560085
Ph. No.: 080-26721983 ext 340
Mob: +91 810 554 7886
e-mail: prashanthakarunakar@pes.edu
https://sites.google.com/site/prashanthakarunakar/home
Bioinformatics
NGS analysis
Protein Structure analysis
Data mining and Database
Development
Technical writing
• NGS data analysis
NGS data analysis for comparative genomics, high-throughput polymorphism
detection,analysis of coding and non-coding RNAs and identifying mutant genes in
disease pathways.
• Protein Structure-function analysis
Analyze the contribution of amino acid mutation towards the change in protein
structure conformation and further its effect on functionality.
• Data mining and Database Development
Curate the information in custom designed formats and create an ontological database.
• Technical writing
Technical writing support involves the communication of complex information to those
who need it to accomplish some task or goal like thesis, research articles etc.
Chemoinformatics
Virtual Screening
Lead identification
Lead optimization
ADMET Prediction
Molecular Docking and Dynamics
Simulation Studies
Molecular Docking and Dynamics Simulation Studies
Focussed on molecular recognition process by using molecular docking and dynamics
simulation. It aims to achieve an optimized conformation for both the DNA-Ligand or
Protein-Ligand or Protein-Protein interaction such that the free energy of the overall system
is minimized.
Protein-Ligand Interaction DNA-Ligand Interaction Protein-Ligand Interaction Ligplot representation of
Protein-Ligand interaction
Protein and small molecule
Structure determination
Protein crystal data Analysis
and algorithm development
Structural Bioinformatics
Protein and small molecule Structure determination
Determination of crystal structure either of protein or small molecule. Support you towards
understanding the functionality of the structure by generating high quality images like the
packing diagrams etc. which helps to communicate your work to peer reviewed journals for the
publications
Data Analysis and algorithm development
With rich experience in structural bioinformatics, pioneered in data extraction from biological sequence or structural
databases and developing new methodology or algorithm to solve biological problems.
Packing diagram
Python Based Bioinformatics Software Development
• Bio-python is a collection of python modules that facilitate the development of python scripts for
bioinformatics applications.
• Bio-python provides reusable python modules that facilitate writing scripts for sequence manipulation,
accessing of databases using a range of data formats and execution and parsing of the results of various
molecular biology programs.
• Consequently, Bio-python enables developing scripts that can analyze large quantities of sequence data
in ways that are typically difficult or impossible with web based systems.
Publications
1. Nagaraj M K, Karunakar P, Inhibition of Leukocidin F of Staphylococcus aureus: An In Silico Approach, Int J Com Bio &
Bioinfo, (2016); 1(1), 16 - 20
2. Megha Vivek, Prashantha Karunakar, Evaluation of plants extracts for acetylcholinesterase inhibitory activity and GSK-3
(2016), International Journal of Advanced Scientific Research and Publications, V2-3 , 29-34
3. Tanashree Kalghatgi, Vishaly K, Divya MS, Prashantha Karunakar, Evaluation of Antioxidant, Antimicrobial and Anti-
breast Cancer Activity of Butea monosperma,Nigella sativa and Centella asiatica: An in vitro and in silico approach,
International Journal of Computational Biology and Bioinformatics (2016), V1-1, page no 01-06
4. Manjegowda D S, Karunakar P, Ramachandra N B. Effect of structural changes in proteins derived from GATA4
nonsynonymous single nucleotide polymorphisms in congenital heart disease. Indian J Pharm Sci, 2015;77:735-41 (ISSN
0250-474X)
5. K S Kiran, M K Kokila, Guruprasad R, Prashantha Karunakar, M A Pasha, Lokanath N, Naveen S, Crystal and Molecular
docking studies of 3-[Bis-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohex-1-enyl)-methyl]benzonitrile with focal adhesion kinase
inhibitors, Der Pharma Chemica, 2015, 7(9):268-273 (ISSN 0975-413X)
6. Krithika, R., Jyothilakshmi, V., Prashantha, K. & Verma, R.J. Mechanism of protective effect of phyllanthin against carbon
tetrachloride-induced hepatotoxicity and experimental liver fibrosis in mice. Toxicology Mechanisms and Methods, 1-10
(2015).DOI:10.3109/15376516.2015.1077361 ISSN: 1537-6516 (print), 1537-6524 (electronic)
7. Prashantha Karunakar, Chamarahalli Ramakrishnaiyer Girija, Venkatappa Krishnamurthy, Venkatarangaiah Krishna, and
Kunigal Venugopal Shivakumar, “In Silico Antitubercular Activity Analysis of Benzofuran and Naphthofuran
Derivatives,” Tuberculosis Research and Treatment, vol. 2014, Article ID 697532, 10 pages,
2014. doi:10.1155/2014/697532
8. Shivakumar K V, Prashantha Karunakar, Jhinuk Chatterjee., Inhibition of NarL of Mycobacterium tuberculosis:
An in silico approach., Interdisciplinary Sciences: Computational Life Sciences, Springer Publications. 2014. 6:1-8 (print
ISSN: 1913-2751)
9. Prashantha Karunakar, V. Krishnamurthy, C. R. Girija and V. Krishna., Crystal Structure and Molecular Docking Analysis of
Difurfurylidene Succinic Acid With Cyclooxygenases, International Journal of Pharma and Bio Sciences, 2013, 4(3): (B) 912
– 921 (ISSN 0975-6299)
10. A. J. Yamuna, P. Karunakar,C. R. Girija, V. P. Vaidya and V. Krishnamurthy., Ethyl 3-amino-5-bromo-1-benzofuran-2-
carboxylate, Acta Crystallographica Section E, 2013; E69, o775 (ISSN 1600-5368)
11. Bhattacharjee, Biplab., Rose Mary Simon., Chaithra Gangadharaiah., Prashantha Karunakar., Chemogenomics Profiling of
Drug Targets of Peptidoglycan Biosynthesis Pathway in Leptospira interrogans by Virtual Screening Approaches., Journal of
Microbiology and Biotechnology. 2013, 23(6), 779-784 (Online ISSN: 1738-8872 Print ISSN: 1017-7825)
12. Prashantha Karunakar, V.Krishnamurthy, C. R. Girija, V. Krishna,V. P. Vaidya and A. J. Yamuna., Ethyl 5-bromo-3-
ethoxycarbonylamino-1-benzofuran-2-carboxylate, Acta Crystallographica Section E, 2013; E69, o342 (ISSN 1600-5368)
Publications
Publications
13. C. R. Girija, S. Shalini, M. M. Jotani, K. Prashantha, K.N.Venugopala and T.V. Venkatesha., Semi-empirical Quantum
Chemical calculations and Hirshfeld Surface Analysis in 2,6-Bis(2-Furanyl methylidene) cyclohexanone, conference
proceedings of National Conference on ‘Challenges and Opportunities for Chemical Sciences in 21st Century’ 2013, 7-14
(ISBN: 978-81-923301-9-8)
14. S. Shalini, C. R. Girija, Prashantha Karunakar, M. M. Jotani, K.N. Venugopala, T V Venkatesh., Synthesis, Characterisation,
Docking Analysis and Biological Evaluation of a,a’-bis(p-dimethylamino-benzylidene)-γ-methylcyclohexanone, Indian
Journal of Chemistry (Section B), 2013; 52B: 282-288. ISSN (Online 0975-0983; Print 0376-4699)
15. Prashantha Karunakar, V Krishnamurthy, C R Girija, V Krishna, D E Vasundhara, Noor Shahina Begum, Akheel Ahmed
Syed., In silico Docking analysis of Piperine with Cyclooxygenases., Journal of Biochemical Technology, 2012; 3(5): S122-
127 (ISSN : 0974-2328)
16. Biplab Bhattacharjee, Jhinuk Chattejee, Prashantha Karunakar., A Comparative Reverse Screening Approach to Identify
Potential Anti-neoplastic Targets of Saffron Functional Components and Binding Mode., Asian Pacific Journal of Cancer
Prevention, 2012; 13(11): 5605-5611. (ISSN: 1513-7368)
17. Preu, J, Panjikar S, Morth P, Jaswal R, Karunakar P, Tucker P A, The sensor region of the ubiquitous cytosolic sensor
kinase, PdtaS, contains PAS and GAF domain sensing modules, Journal of structural Biology, 2012; 177: 498–505. (ISSN:
1047-8477) (PDB ID’s deposited: 2YKH, 2YKF)
18. Prashantha Karunakar, Venkatappa Krishnamurthy, Chamarahalli Ramakrishnaiyer Girija,Venkatarangaiah Krishna,
Dindare Eswarappa Vasundhara, Noor Shahina Begum, Akheel Ahmed Syed., Molecular interaction of fenvalarate with
actin, Bioinformation., 2011, 7(5): 234-238. ISSN (Online 0973-2063; Print 0973-8894)
Publications
19. Prashantha Karunakar, B. S. Ravindranath, W. A. Sadik Ahmed., Computational Approach to Design a Potential
Inhibitor for HIV and Mycobacterium. Advanced biotech., 2010; 10(4): 23-25 ISSN (Online 2319-6750; Print 0973-
0109)
20. Dinesh S.M, Prashantha Karunakar, C. Amruthavalli, Nallur B Ramachandra., Analysis and Homology Modeling of
Proteins Derived from NKX2.5 Non-synonymous Single Nucleotide Polymorphisms Involved in Congenital Heart
Disease. Nature and Science. 2010; 8(9):27-38. (ISSN: 1545-0740)
21. Girija CR, Karunakar P, Poojari CS, Begum NS, Syed AA., Molecular Docking Studies of Curcumin Derivatives with
Multiple Protein Targets for Procarcinogen Activating Enzyme Inhibition. Journal of Proteomics and
Bioinformatics, 2010, (3): 200-203. (ISSN:0974-276X)

More Related Content

What's hot

Arvind Dabhade_CV (3)4
Arvind Dabhade_CV (3)4Arvind Dabhade_CV (3)4
Arvind Dabhade_CV (3)4Arvind Dabhade
 
How the artificial intelligence tool iPGK-PseAAC is working in predicting lys...
How the artificial intelligence tool iPGK-PseAAC is working in predicting lys...How the artificial intelligence tool iPGK-PseAAC is working in predicting lys...
How the artificial intelligence tool iPGK-PseAAC is working in predicting lys...
IJBNT Journal
 
The pLoc bal-mHum is a powerful web-serve for predicting the subcellular loca...
The pLoc bal-mHum is a powerful web-serve for predicting the subcellular loca...The pLoc bal-mHum is a powerful web-serve for predicting the subcellular loca...
The pLoc bal-mHum is a powerful web-serve for predicting the subcellular loca...
IJBNT Journal
 
CV Girish sept
CV Girish septCV Girish sept
CV Girish septGirish Rai
 
RESUME SIVAKUMAR S
RESUME SIVAKUMAR SRESUME SIVAKUMAR S
RESUME SIVAKUMAR Ssiva kumar
 
Al-Amin Bio-data Modi-latest
Al-Amin Bio-data Modi-latestAl-Amin Bio-data Modi-latest
Al-Amin Bio-data Modi-latestDr. Md. Al-Amin
 
Curriculum vitae Bahaderjeet - cup
Curriculum vitae Bahaderjeet - cupCurriculum vitae Bahaderjeet - cup
Curriculum vitae Bahaderjeet - cupbahaderjit singh
 
POTENTIAL OF CURCUMIN IN PYRAMID CELL NECROSIS OF MICE (MUS MUSCULUS) DUE TO ...
POTENTIAL OF CURCUMIN IN PYRAMID CELL NECROSIS OF MICE (MUS MUSCULUS) DUE TO ...POTENTIAL OF CURCUMIN IN PYRAMID CELL NECROSIS OF MICE (MUS MUSCULUS) DUE TO ...
POTENTIAL OF CURCUMIN IN PYRAMID CELL NECROSIS OF MICE (MUS MUSCULUS) DUE TO ...
IAEME Publication
 
CV 2018
CV  2018CV  2018
CV 2018
Bhaskar G
 
Abstracts: HortFlora Res. Spectrum, vol. 4(4) dec 2015
Abstracts: HortFlora Res. Spectrum,  vol. 4(4) dec 2015  Abstracts: HortFlora Res. Spectrum,  vol. 4(4) dec 2015
Abstracts: HortFlora Res. Spectrum, vol. 4(4) dec 2015
HortFlora Research Spectrum
 
Prevalence and antibiotic sensitivity of enterohaemorrhagic.......
Prevalence and antibiotic sensitivity of enterohaemorrhagic.......Prevalence and antibiotic sensitivity of enterohaemorrhagic.......
Prevalence and antibiotic sensitivity of enterohaemorrhagic.......kamrul hassan
 

What's hot (19)

dtpcv Dec 2016
dtpcv Dec 2016dtpcv Dec 2016
dtpcv Dec 2016
 
dtpcv M2015
dtpcv M2015dtpcv M2015
dtpcv M2015
 
Rajesh Resume2016
Rajesh Resume2016Rajesh Resume2016
Rajesh Resume2016
 
MMK_PUB1
MMK_PUB1MMK_PUB1
MMK_PUB1
 
Arvind Dabhade_CV (3)4
Arvind Dabhade_CV (3)4Arvind Dabhade_CV (3)4
Arvind Dabhade_CV (3)4
 
How the artificial intelligence tool iPGK-PseAAC is working in predicting lys...
How the artificial intelligence tool iPGK-PseAAC is working in predicting lys...How the artificial intelligence tool iPGK-PseAAC is working in predicting lys...
How the artificial intelligence tool iPGK-PseAAC is working in predicting lys...
 
The pLoc bal-mHum is a powerful web-serve for predicting the subcellular loca...
The pLoc bal-mHum is a powerful web-serve for predicting the subcellular loca...The pLoc bal-mHum is a powerful web-serve for predicting the subcellular loca...
The pLoc bal-mHum is a powerful web-serve for predicting the subcellular loca...
 
CV Girish sept
CV Girish septCV Girish sept
CV Girish sept
 
Selvarajan-e resume
Selvarajan-e resumeSelvarajan-e resume
Selvarajan-e resume
 
Khushali Upadhyay
Khushali UpadhyayKhushali Upadhyay
Khushali Upadhyay
 
RESUME SIVAKUMAR S
RESUME SIVAKUMAR SRESUME SIVAKUMAR S
RESUME SIVAKUMAR S
 
Example academic CV
Example academic CVExample academic CV
Example academic CV
 
Al-Amin Bio-data Modi-latest
Al-Amin Bio-data Modi-latestAl-Amin Bio-data Modi-latest
Al-Amin Bio-data Modi-latest
 
Curriculum vitae Bahaderjeet - cup
Curriculum vitae Bahaderjeet - cupCurriculum vitae Bahaderjeet - cup
Curriculum vitae Bahaderjeet - cup
 
POTENTIAL OF CURCUMIN IN PYRAMID CELL NECROSIS OF MICE (MUS MUSCULUS) DUE TO ...
POTENTIAL OF CURCUMIN IN PYRAMID CELL NECROSIS OF MICE (MUS MUSCULUS) DUE TO ...POTENTIAL OF CURCUMIN IN PYRAMID CELL NECROSIS OF MICE (MUS MUSCULUS) DUE TO ...
POTENTIAL OF CURCUMIN IN PYRAMID CELL NECROSIS OF MICE (MUS MUSCULUS) DUE TO ...
 
CV 2018
CV  2018CV  2018
CV 2018
 
Abstracts: HortFlora Res. Spectrum, vol. 4(4) dec 2015
Abstracts: HortFlora Res. Spectrum,  vol. 4(4) dec 2015  Abstracts: HortFlora Res. Spectrum,  vol. 4(4) dec 2015
Abstracts: HortFlora Res. Spectrum, vol. 4(4) dec 2015
 
Prevalence and antibiotic sensitivity of enterohaemorrhagic.......
Prevalence and antibiotic sensitivity of enterohaemorrhagic.......Prevalence and antibiotic sensitivity of enterohaemorrhagic.......
Prevalence and antibiotic sensitivity of enterohaemorrhagic.......
 
Abhilash's CV
Abhilash's CVAbhilash's CV
Abhilash's CV
 

Viewers also liked

Sergi Fluorescence
Sergi FluorescenceSergi Fluorescence
Sergi Fluorescence
poutreda
 
Computational molecular biophysics of ribonucleic acids and ribozymes
Computational molecular biophysics of ribonucleic acids and ribozymesComputational molecular biophysics of ribonucleic acids and ribozymes
Computational molecular biophysics of ribonucleic acids and ribozymes
chrisltang
 
Bba 301 Assignment 8.2 Fret
Bba 301 Assignment 8.2 FretBba 301 Assignment 8.2 Fret
Bba 301 Assignment 8.2 Fret
nmanuel
 
Fluorescence recovery after photo bleaching
Fluorescence recovery after photo bleachingFluorescence recovery after photo bleaching
Fluorescence recovery after photo bleachinganasshokor
 
FRET BIOL 497 Presentation
FRET BIOL 497 PresentationFRET BIOL 497 Presentation
FRET BIOL 497 PresentationSaki Mihori
 
Fluorescence recovery after photobleaching
Fluorescence recovery after photobleachingFluorescence recovery after photobleaching
Fluorescence recovery after photobleaching
1aditi1
 
Making organelles visible - in planta and in societas
Making organelles visible - in planta and in societasMaking organelles visible - in planta and in societas
Making organelles visible - in planta and in societas
Anne Osterrieder
 
PEPTIDE NUCLEIC ACID
PEPTIDE NUCLEIC ACID PEPTIDE NUCLEIC ACID
PEPTIDE NUCLEIC ACID
darwin1988
 
Peptide nucleic acid
Peptide nucleic acidPeptide nucleic acid
Peptide nucleic acid
Aref Farokhi Fard
 
Energy Resonance Study, France 2005
Energy Resonance Study, France 2005Energy Resonance Study, France 2005
Energy Resonance Study, France 2005Thina3
 
Isothermal Nucleic Acid Amplification Techniques
Isothermal Nucleic Acid Amplification TechniquesIsothermal Nucleic Acid Amplification Techniques
Isothermal Nucleic Acid Amplification Techniques
Aref Farokhi Fard
 
Fluorescence(Forster) Resonance Energy Transfer
Fluorescence(Forster) Resonance Energy TransferFluorescence(Forster) Resonance Energy Transfer
Fluorescence(Forster) Resonance Energy Transfersavvysahana
 
''Electrophoretic Mobility Shift Assay'' by KATE, Wisdom Deebeke
''Electrophoretic Mobility Shift Assay'' by KATE, Wisdom Deebeke''Electrophoretic Mobility Shift Assay'' by KATE, Wisdom Deebeke
''Electrophoretic Mobility Shift Assay'' by KATE, Wisdom Deebeke
Wisdom Deebeke Kate
 
Lecture on nucleic acid and proteins
Lecture on nucleic acid and proteinsLecture on nucleic acid and proteins
Lecture on nucleic acid and proteinsMarilen Parungao
 
Protein dna interaction
Protein dna interactionProtein dna interaction
Protein dna interaction
Prasanthperceptron
 
Fluorescence microscopy introduction
Fluorescence microscopy introductionFluorescence microscopy introduction
Fluorescence microscopy introduction
Nicole Salgado Cortes
 
FRET Microscopy Presentation
FRET Microscopy PresentationFRET Microscopy Presentation
FRET Microscopy PresentationVallery Salomon
 

Viewers also liked (20)

Sergi Fluorescence
Sergi FluorescenceSergi Fluorescence
Sergi Fluorescence
 
Computational molecular biophysics of ribonucleic acids and ribozymes
Computational molecular biophysics of ribonucleic acids and ribozymesComputational molecular biophysics of ribonucleic acids and ribozymes
Computational molecular biophysics of ribonucleic acids and ribozymes
 
Bba 301 Assignment 8.2 Fret
Bba 301 Assignment 8.2 FretBba 301 Assignment 8.2 Fret
Bba 301 Assignment 8.2 Fret
 
DNA methylation
DNA methylationDNA methylation
DNA methylation
 
Calorimeter
CalorimeterCalorimeter
Calorimeter
 
Fluorescence recovery after photo bleaching
Fluorescence recovery after photo bleachingFluorescence recovery after photo bleaching
Fluorescence recovery after photo bleaching
 
FRET BIOL 497 Presentation
FRET BIOL 497 PresentationFRET BIOL 497 Presentation
FRET BIOL 497 Presentation
 
Fluorescence recovery after photobleaching
Fluorescence recovery after photobleachingFluorescence recovery after photobleaching
Fluorescence recovery after photobleaching
 
Making organelles visible - in planta and in societas
Making organelles visible - in planta and in societasMaking organelles visible - in planta and in societas
Making organelles visible - in planta and in societas
 
PEPTIDE NUCLEIC ACID
PEPTIDE NUCLEIC ACID PEPTIDE NUCLEIC ACID
PEPTIDE NUCLEIC ACID
 
Peptide nucleic acid
Peptide nucleic acidPeptide nucleic acid
Peptide nucleic acid
 
Energy Resonance Study, France 2005
Energy Resonance Study, France 2005Energy Resonance Study, France 2005
Energy Resonance Study, France 2005
 
Isothermal Nucleic Acid Amplification Techniques
Isothermal Nucleic Acid Amplification TechniquesIsothermal Nucleic Acid Amplification Techniques
Isothermal Nucleic Acid Amplification Techniques
 
Fluorescence(Forster) Resonance Energy Transfer
Fluorescence(Forster) Resonance Energy TransferFluorescence(Forster) Resonance Energy Transfer
Fluorescence(Forster) Resonance Energy Transfer
 
G7 ch2.1 cells and life
G7 ch2.1   cells and lifeG7 ch2.1   cells and life
G7 ch2.1 cells and life
 
''Electrophoretic Mobility Shift Assay'' by KATE, Wisdom Deebeke
''Electrophoretic Mobility Shift Assay'' by KATE, Wisdom Deebeke''Electrophoretic Mobility Shift Assay'' by KATE, Wisdom Deebeke
''Electrophoretic Mobility Shift Assay'' by KATE, Wisdom Deebeke
 
Lecture on nucleic acid and proteins
Lecture on nucleic acid and proteinsLecture on nucleic acid and proteins
Lecture on nucleic acid and proteins
 
Protein dna interaction
Protein dna interactionProtein dna interaction
Protein dna interaction
 
Fluorescence microscopy introduction
Fluorescence microscopy introductionFluorescence microscopy introduction
Fluorescence microscopy introduction
 
FRET Microscopy Presentation
FRET Microscopy PresentationFRET Microscopy Presentation
FRET Microscopy Presentation
 

Similar to Prashantha_Docking

Ouellette, Michael_Resume 2016
Ouellette, Michael_Resume 2016Ouellette, Michael_Resume 2016
Ouellette, Michael_Resume 2016Mike Ouellette
 
Curriculum vitae bharat patnaik.doc
Curriculum vitae bharat patnaik.docCurriculum vitae bharat patnaik.doc
Curriculum vitae bharat patnaik.doc
Bharat Bhusan Patnaik
 
Tuniki Balaraju_Curriculum Vitae-AUGUST-2016
Tuniki Balaraju_Curriculum Vitae-AUGUST-2016Tuniki Balaraju_Curriculum Vitae-AUGUST-2016
Tuniki Balaraju_Curriculum Vitae-AUGUST-2016Tuniki Balaraju
 
IFPRI- NAIP - Computational Framework to Support Biotechnological Research
IFPRI- NAIP - Computational Framework to Support  Biotechnological Research  IFPRI- NAIP - Computational Framework to Support  Biotechnological Research
IFPRI- NAIP - Computational Framework to Support Biotechnological Research
International Food Policy Research Institute- South Asia Office
 
RTGEB2023 Poster.pdf
RTGEB2023 Poster.pdfRTGEB2023 Poster.pdf
RTGEB2023 Poster.pdf
Senthilkumar Palanisamy
 
Dr.B N Chaitanya
Dr.B N ChaitanyaDr.B N Chaitanya
Dr.B N Chaitanya
Dr. B N CHAITANYA
 
Dr. B. N. Chaitanya
Dr. B. N. Chaitanya Dr. B. N. Chaitanya
Dr. B. N. Chaitanya
Dr. B N CHAITANYA
 
Resume - dec 2015
Resume - dec 2015Resume - dec 2015
Resume - dec 2015abdhul kaja
 
Vasantharajan janakiraman 1_resume_july_2016
Vasantharajan janakiraman 1_resume_july_2016Vasantharajan janakiraman 1_resume_july_2016
Vasantharajan janakiraman 1_resume_july_2016
Vasant Janakiraman
 
Ramabhadra c.v (2)
Ramabhadra c.v (2)Ramabhadra c.v (2)
Ramabhadra c.v (2)
Santosh Rama Bhadra Tata
 
CV_Shahid_Manzoor-2016
CV_Shahid_Manzoor-2016CV_Shahid_Manzoor-2016
CV_Shahid_Manzoor-2016SHAHID Manzoor
 

Similar to Prashantha_Docking (20)

CURRICULAM VITAE (2)
CURRICULAM VITAE (2)CURRICULAM VITAE (2)
CURRICULAM VITAE (2)
 
Ouellette, Michael_Resume 2016
Ouellette, Michael_Resume 2016Ouellette, Michael_Resume 2016
Ouellette, Michael_Resume 2016
 
Naveen Kumar Resume
Naveen Kumar ResumeNaveen Kumar Resume
Naveen Kumar Resume
 
Curriculum vitae bharat patnaik.doc
Curriculum vitae bharat patnaik.docCurriculum vitae bharat patnaik.doc
Curriculum vitae bharat patnaik.doc
 
Tuniki Balaraju_Curriculum Vitae-AUGUST-2016
Tuniki Balaraju_Curriculum Vitae-AUGUST-2016Tuniki Balaraju_Curriculum Vitae-AUGUST-2016
Tuniki Balaraju_Curriculum Vitae-AUGUST-2016
 
IFPRI- NAIP - Computational Framework to Support Biotechnological Research
IFPRI- NAIP - Computational Framework to Support  Biotechnological Research  IFPRI- NAIP - Computational Framework to Support  Biotechnological Research
IFPRI- NAIP - Computational Framework to Support Biotechnological Research
 
MARIMUTHU CHINNARASU PROFILE (1)
MARIMUTHU CHINNARASU PROFILE (1)MARIMUTHU CHINNARASU PROFILE (1)
MARIMUTHU CHINNARASU PROFILE (1)
 
RTGEB2023 Poster.pdf
RTGEB2023 Poster.pdfRTGEB2023 Poster.pdf
RTGEB2023 Poster.pdf
 
Purushotham Reddy -SW.- CV
Purushotham Reddy -SW.- CVPurushotham Reddy -SW.- CV
Purushotham Reddy -SW.- CV
 
Resume_2016
Resume_2016Resume_2016
Resume_2016
 
Dr.B N Chaitanya
Dr.B N ChaitanyaDr.B N Chaitanya
Dr.B N Chaitanya
 
Dr. B. N. Chaitanya
Dr. B. N. Chaitanya Dr. B. N. Chaitanya
Dr. B. N. Chaitanya
 
Resume - dec 2015
Resume - dec 2015Resume - dec 2015
Resume - dec 2015
 
updated resume
updated resumeupdated resume
updated resume
 
Shyama_Resume
Shyama_ResumeShyama_Resume
Shyama_Resume
 
Resume
ResumeResume
Resume
 
Vasantharajan janakiraman 1_resume_july_2016
Vasantharajan janakiraman 1_resume_july_2016Vasantharajan janakiraman 1_resume_july_2016
Vasantharajan janakiraman 1_resume_july_2016
 
Ramabhadra c.v (2)
Ramabhadra c.v (2)Ramabhadra c.v (2)
Ramabhadra c.v (2)
 
CV_Shahid_Manzoor-2016
CV_Shahid_Manzoor-2016CV_Shahid_Manzoor-2016
CV_Shahid_Manzoor-2016
 
Puja Sarkar CV
Puja Sarkar CVPuja Sarkar CV
Puja Sarkar CV
 

Prashantha_Docking

  • 1. Protein/DNAProtein/DNAProtein/DNAProtein/DNA –––– LigandLigandLigandLigand InteractionInteractionInteractionInteraction Dr. Prashantha Karunakar Assistant Professor Department of Biotechnology 100 Feet Ring Road, Banashankari 3rd Stage PES University Bangalore - 560085 Ph. No.: 080-26721983 ext 340 Mob: +91 810 554 7886 e-mail: prashanthakarunakar@pes.edu https://sites.google.com/site/prashanthakarunakar/home
  • 2. Bioinformatics NGS analysis Protein Structure analysis Data mining and Database Development Technical writing • NGS data analysis NGS data analysis for comparative genomics, high-throughput polymorphism detection,analysis of coding and non-coding RNAs and identifying mutant genes in disease pathways. • Protein Structure-function analysis Analyze the contribution of amino acid mutation towards the change in protein structure conformation and further its effect on functionality. • Data mining and Database Development Curate the information in custom designed formats and create an ontological database. • Technical writing Technical writing support involves the communication of complex information to those who need it to accomplish some task or goal like thesis, research articles etc.
  • 3. Chemoinformatics Virtual Screening Lead identification Lead optimization ADMET Prediction Molecular Docking and Dynamics Simulation Studies Molecular Docking and Dynamics Simulation Studies Focussed on molecular recognition process by using molecular docking and dynamics simulation. It aims to achieve an optimized conformation for both the DNA-Ligand or Protein-Ligand or Protein-Protein interaction such that the free energy of the overall system is minimized. Protein-Ligand Interaction DNA-Ligand Interaction Protein-Ligand Interaction Ligplot representation of Protein-Ligand interaction
  • 4. Protein and small molecule Structure determination Protein crystal data Analysis and algorithm development Structural Bioinformatics Protein and small molecule Structure determination Determination of crystal structure either of protein or small molecule. Support you towards understanding the functionality of the structure by generating high quality images like the packing diagrams etc. which helps to communicate your work to peer reviewed journals for the publications Data Analysis and algorithm development With rich experience in structural bioinformatics, pioneered in data extraction from biological sequence or structural databases and developing new methodology or algorithm to solve biological problems. Packing diagram
  • 5. Python Based Bioinformatics Software Development • Bio-python is a collection of python modules that facilitate the development of python scripts for bioinformatics applications. • Bio-python provides reusable python modules that facilitate writing scripts for sequence manipulation, accessing of databases using a range of data formats and execution and parsing of the results of various molecular biology programs. • Consequently, Bio-python enables developing scripts that can analyze large quantities of sequence data in ways that are typically difficult or impossible with web based systems.
  • 6. Publications 1. Nagaraj M K, Karunakar P, Inhibition of Leukocidin F of Staphylococcus aureus: An In Silico Approach, Int J Com Bio & Bioinfo, (2016); 1(1), 16 - 20 2. Megha Vivek, Prashantha Karunakar, Evaluation of plants extracts for acetylcholinesterase inhibitory activity and GSK-3 (2016), International Journal of Advanced Scientific Research and Publications, V2-3 , 29-34 3. Tanashree Kalghatgi, Vishaly K, Divya MS, Prashantha Karunakar, Evaluation of Antioxidant, Antimicrobial and Anti- breast Cancer Activity of Butea monosperma,Nigella sativa and Centella asiatica: An in vitro and in silico approach, International Journal of Computational Biology and Bioinformatics (2016), V1-1, page no 01-06 4. Manjegowda D S, Karunakar P, Ramachandra N B. Effect of structural changes in proteins derived from GATA4 nonsynonymous single nucleotide polymorphisms in congenital heart disease. Indian J Pharm Sci, 2015;77:735-41 (ISSN 0250-474X) 5. K S Kiran, M K Kokila, Guruprasad R, Prashantha Karunakar, M A Pasha, Lokanath N, Naveen S, Crystal and Molecular docking studies of 3-[Bis-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohex-1-enyl)-methyl]benzonitrile with focal adhesion kinase inhibitors, Der Pharma Chemica, 2015, 7(9):268-273 (ISSN 0975-413X) 6. Krithika, R., Jyothilakshmi, V., Prashantha, K. & Verma, R.J. Mechanism of protective effect of phyllanthin against carbon tetrachloride-induced hepatotoxicity and experimental liver fibrosis in mice. Toxicology Mechanisms and Methods, 1-10 (2015).DOI:10.3109/15376516.2015.1077361 ISSN: 1537-6516 (print), 1537-6524 (electronic)
  • 7. 7. Prashantha Karunakar, Chamarahalli Ramakrishnaiyer Girija, Venkatappa Krishnamurthy, Venkatarangaiah Krishna, and Kunigal Venugopal Shivakumar, “In Silico Antitubercular Activity Analysis of Benzofuran and Naphthofuran Derivatives,” Tuberculosis Research and Treatment, vol. 2014, Article ID 697532, 10 pages, 2014. doi:10.1155/2014/697532 8. Shivakumar K V, Prashantha Karunakar, Jhinuk Chatterjee., Inhibition of NarL of Mycobacterium tuberculosis: An in silico approach., Interdisciplinary Sciences: Computational Life Sciences, Springer Publications. 2014. 6:1-8 (print ISSN: 1913-2751) 9. Prashantha Karunakar, V. Krishnamurthy, C. R. Girija and V. Krishna., Crystal Structure and Molecular Docking Analysis of Difurfurylidene Succinic Acid With Cyclooxygenases, International Journal of Pharma and Bio Sciences, 2013, 4(3): (B) 912 – 921 (ISSN 0975-6299) 10. A. J. Yamuna, P. Karunakar,C. R. Girija, V. P. Vaidya and V. Krishnamurthy., Ethyl 3-amino-5-bromo-1-benzofuran-2- carboxylate, Acta Crystallographica Section E, 2013; E69, o775 (ISSN 1600-5368) 11. Bhattacharjee, Biplab., Rose Mary Simon., Chaithra Gangadharaiah., Prashantha Karunakar., Chemogenomics Profiling of Drug Targets of Peptidoglycan Biosynthesis Pathway in Leptospira interrogans by Virtual Screening Approaches., Journal of Microbiology and Biotechnology. 2013, 23(6), 779-784 (Online ISSN: 1738-8872 Print ISSN: 1017-7825) 12. Prashantha Karunakar, V.Krishnamurthy, C. R. Girija, V. Krishna,V. P. Vaidya and A. J. Yamuna., Ethyl 5-bromo-3- ethoxycarbonylamino-1-benzofuran-2-carboxylate, Acta Crystallographica Section E, 2013; E69, o342 (ISSN 1600-5368) Publications
  • 8. Publications 13. C. R. Girija, S. Shalini, M. M. Jotani, K. Prashantha, K.N.Venugopala and T.V. Venkatesha., Semi-empirical Quantum Chemical calculations and Hirshfeld Surface Analysis in 2,6-Bis(2-Furanyl methylidene) cyclohexanone, conference proceedings of National Conference on ‘Challenges and Opportunities for Chemical Sciences in 21st Century’ 2013, 7-14 (ISBN: 978-81-923301-9-8) 14. S. Shalini, C. R. Girija, Prashantha Karunakar, M. M. Jotani, K.N. Venugopala, T V Venkatesh., Synthesis, Characterisation, Docking Analysis and Biological Evaluation of a,a’-bis(p-dimethylamino-benzylidene)-γ-methylcyclohexanone, Indian Journal of Chemistry (Section B), 2013; 52B: 282-288. ISSN (Online 0975-0983; Print 0376-4699) 15. Prashantha Karunakar, V Krishnamurthy, C R Girija, V Krishna, D E Vasundhara, Noor Shahina Begum, Akheel Ahmed Syed., In silico Docking analysis of Piperine with Cyclooxygenases., Journal of Biochemical Technology, 2012; 3(5): S122- 127 (ISSN : 0974-2328) 16. Biplab Bhattacharjee, Jhinuk Chattejee, Prashantha Karunakar., A Comparative Reverse Screening Approach to Identify Potential Anti-neoplastic Targets of Saffron Functional Components and Binding Mode., Asian Pacific Journal of Cancer Prevention, 2012; 13(11): 5605-5611. (ISSN: 1513-7368) 17. Preu, J, Panjikar S, Morth P, Jaswal R, Karunakar P, Tucker P A, The sensor region of the ubiquitous cytosolic sensor kinase, PdtaS, contains PAS and GAF domain sensing modules, Journal of structural Biology, 2012; 177: 498–505. (ISSN: 1047-8477) (PDB ID’s deposited: 2YKH, 2YKF) 18. Prashantha Karunakar, Venkatappa Krishnamurthy, Chamarahalli Ramakrishnaiyer Girija,Venkatarangaiah Krishna, Dindare Eswarappa Vasundhara, Noor Shahina Begum, Akheel Ahmed Syed., Molecular interaction of fenvalarate with actin, Bioinformation., 2011, 7(5): 234-238. ISSN (Online 0973-2063; Print 0973-8894)
  • 9. Publications 19. Prashantha Karunakar, B. S. Ravindranath, W. A. Sadik Ahmed., Computational Approach to Design a Potential Inhibitor for HIV and Mycobacterium. Advanced biotech., 2010; 10(4): 23-25 ISSN (Online 2319-6750; Print 0973- 0109) 20. Dinesh S.M, Prashantha Karunakar, C. Amruthavalli, Nallur B Ramachandra., Analysis and Homology Modeling of Proteins Derived from NKX2.5 Non-synonymous Single Nucleotide Polymorphisms Involved in Congenital Heart Disease. Nature and Science. 2010; 8(9):27-38. (ISSN: 1545-0740) 21. Girija CR, Karunakar P, Poojari CS, Begum NS, Syed AA., Molecular Docking Studies of Curcumin Derivatives with Multiple Protein Targets for Procarcinogen Activating Enzyme Inhibition. Journal of Proteomics and Bioinformatics, 2010, (3): 200-203. (ISSN:0974-276X)