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Muthukumarasamy Karthikeyan
Muthukumarasamy Karthikeyan
Chief Scientist, Molecular Informatics, National Chem. Lab, ( CSIR ) Pune, India
Verified email at ncl.res.in - Homepage
Title
Cited by
Cited by
Year
General melting point prediction based on a diverse compound data set and artificial neural networks
M Karthikeyan, RC Glen, A Bender
Journal of chemical information and modeling 45 (3), 581-590, 2005
1532005
New intramolecular α-arylation strategy of ketones by the reaction of silyl enol ethers to photosensitized electron transfer generated arene radical cations: construction of …
G Pandey, M Karthikeyan, A Murugan
The Journal of Organic Chemistry 63 (9), 2867-2872, 1998
451998
Practical chemoinformatics
M Karthikeyan, R Vyas
Springer, 2014
422014
EPZ-10 catalyzed regioselective transformation of alkenes into β-iodo ethers, iodohydrins and 2-iodomethyl-2, 3-dihydrobenzofurans
A Vishal
Green Chemistry 4 (4), 325-327, 2002
392002
Spirochromone-chalcone conjugates as antitubercular agents: synthesis, bio evaluation and molecular modeling studies
M Mujahid, P Yogeeswari, D Sriram, UMV Basavanag, E Díaz-Cervantes, ...
RSC advances 5 (129), 106448-106460, 2015
332015
Intramolecular nucleophilic addition of silylenol ether to photosensitized electron transfer (PET) generated arene radical cations: a novel non-reagent based carboannulation …
G Pandey, A Krishna, K Girija, M Karthikeyan
Tetrahedron letters 34 (41), 6631-6634, 1993
331993
Encoding and decoding graphical chemical structures as two-dimensional (PDF417) barcodes
M Karthikeyan, A Bender
Journal of chemical information and modeling 45 (3), 572-580, 2005
272005
Assessing therapeutic potential of molecules: molecular property diagnostic suite for tuberculosis
AS Gaur, A Bhardwaj, A Sharma, L John, MR Vivek, N Tripathi, ...
Journal of Chemical Sciences 129, 515-531, 2017
202017
Machine Learning Methods in Chemoinformatics for Drug Discovery
M Karthikeyan, R Vyas
Practical Chemoinformatics 1, 133-194, 2014
192014
Distributed chemical computing using ChemStar: an open source java remote method invocation architecture applied to large scale molecular data from PubChem
M Karthikeyan, S Krishnan, AK Pandey, A Bender, A Tropsha
Journal of chemical information and modeling 48 (4), 691-703, 2008
172008
Harvesting chemical information from the Internet using a distributed approach: ChemXtreme
M Karthikeyan, S Krishnan, AK Pandey, A Bender
Journal of chemical information and modeling 46 (2), 452-461, 2006
162006
ChemScreener: A distributed computing tool for scaffold based virtual screening
M Karthikeyan, D Pandit, R Vyas
Combinatorial chemistry & high throughput screening 18 (6), 544-561, 2015
152015
Role of open source tools and resources in virtual screening for drug discovery
M Karthikeyan, R Vyas
Combinatorial chemistry & high throughput screening 18 (6), 528-543, 2015
132015
SIMULATED CARBON AND PROTON NMR CHEMICAL SHIFTS BASED BINARY FINGERPRINTS FOR VIRTUAL SCREENING
M Karthikeyan
WO Patent WO 2014/207670 A1 (http://tinyurl.com/lgpayvu), 2014
13*2014
Remote monitoring and controlling physical parameters of a material under transportation
M Karthikeyan, R Vyas
US Patent 10,628,720, 2020
122020
chemical structure recognition tool
M Karthikeyan
US Patent US 2014/0301608 A1 (http://patentimages.storage.googleapis.com …, 2014
122014
Effect of storage on the properties of vermicompost generated from paper waste: with focus on pre-drying and extent of sealing
M Karthikeyan, S Gajalakshmi, SA Abbasi
International Journal of Energy and Environmental Engineering 5, 291-301, 2014
112014
Chemoinformatics: a tool for modern drug discovery
M Karthikeyan, S Krishnan
International journal of information technology and management 1 (1), 69-82, 2002
112002
A study of applications of machine learning based classification methods for virtual screening of lead molecules
R Vyas, S Bapat, E Jain, S S Tambe, M Karthikeyan, B D Kulkarni
Combinatorial Chemistry & High Throughput Screening 18 (7), 658-672, 2015
102015
Comprehensive molecular docking and dynamic simulations for drug repurposing of clinical drugs against multiple cancer kinase targets
N Shaikh, RK Linthoi, KV Swamy, M Karthikeyan, R Vyas
Journal of Biomolecular Structure and Dynamics 41 (16), 7735-7743, 2023
82023
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Articles 1–20