Electronic structure and properties of organic materials, Computational Design and synthesis of optoelectronic materials, Near Infrared absorbing dyes, Molecular Docking and Drug Design
Ph. D. positions are available for highly motivated UGC-CSIR NET JRF-qualified candidates
Experience :
Post Ph. D.: 12 years
Postdoctoral research: 3 years (University of Rennes-I, France, and National Taiwan University, Taiwan)
Teaching and R & D organization: 19 years
Sponsored R &D Projects:
DST-SERB Fast Track Project 2015-18 (Total cost 22.81 Lakhs).
DST-WOS-A Project, as mentor faculty 2017-2020 (Total cost 19.74 Lakhs, PI- Ms. V. M. Vidya)
CSIR Project 2018-21 (Total cost ~23.96 Lakhs)
Ph.D. Supervised: 03 (Completed); 04 (ongoing)
1. Ms. Promila (Thesis title: Electronic excitations, charge transfer, and diradical character studies in squaraine and croconine functional organic materials). Feb 2014- Aug. 2018 (Awarded Aug 2018).
2. Mr. Anuj Tripathi (Thesis title: Tuning of optical and charge transport properties in linear and star-shaped thiophene based organic materials: A DFT insight). (Oct 2015- Feb 2021) (Awarded Feb 2021).
3. Ms. Vidya V. M. (Thesis title: Computational Design, Synthesis and Optical Properties of Functionalized S-Triazine Derivatives). (Oct 2017- May 2021) (Awarded May 2021).
4. Mr. Vipin Kumar (2021-, ongoing)
5. Mr. Ganesh Gokul (2021- ongoing)
6. Mr. Keshari Hemant Anand (2021, ongoing)
7. Ms. Pankaj Verma (2022- ongoind)
M. Tech. Supervised: 04(Completed);
1. Ms. Arpita Prasantini Joshi (Thesis title: Substituted S-Triazines as Anti-Cancer Agents: A Comparative Molecular Docking Study). (Awarded July 2017).
2. Ms. Arubhi Bansal (Thesis title: Tetrasubstituted Thiophenes as Potential Antimicrobial Biomolecules: A Molecular Docking Study). (Awarded Sept. 2018).
3. Ms. Ananta Ganjoo (Thesis title: Structural Deconstruction of Spleen Tyrosine Kinase Inhibitors: Pharmacophore Modelling, Molecular Docking and 3D QSAR Studies). (Awarded July 2019).
4. Mr. Satyajit Beura (Thesis title: Identification of Potential Inhibitors against Human COX-2 and SARS CoV-2 using Computational Modeling and Molecular Dynamics Simulations). (Awarded July 2020).
Invited lectures delivered in National/ international conferences/ Symposia= 13
Conducted Two GIAN (Global Initiative of Academic Networks) courses under MHRD:
Others:
Research Publications (Publications=106, papers presented in conference=33)
List of publications:
| 106 |
Optoelectronic Design and Charge Transport Properties of Benzodifuran (BDF) Isomers for Organic Electronic Devices: DFT/TD-DFT Insights. Vipin K., Simplice. K., Pankaj V. and Prabhakar Ch* Spectrochimica Acta Part A, 2023, xxx, xxx (IF= 4.831) |
| 105 |
Perovskite Quantum Dots for Fluorescence Turn-Off Detection of Clodinafop Pesticide in Food Samples via Liquid-Liquid Microextraction. Ghinaiya N. V., Prabhakar Ch., and Suresh K. K. ACS Appl. Nano Mater., 2023, xxx, xxxx (IF= 6.140) |
| 104 |
Enhanced Piezo-Photocatalytic properties of New Salophen based Ti (IV) Complexes. Rohini V., Ranjith K., Radhika P., Mahesh S., Ramesh G., Manohar B, Someshwar P. and Prabhakar Ch.* Inorg. Chem. Commun., 2023, 148, 110272 (IF= 3.428) |
| 103 |
Design, Synthesis, Anticancer Activity of New Amide Derivatives derived from 1,2,3- Triazole-Benzofuran Hybrids: An Insights from Molecular Docking, Molecular Dynamics Simulation and DFT studies. Naganjaneyulu G., Shiva Krishna L., Eswar P., Poojitha C., Bhaskar P., Prabhakar Ch., Aribhi B., Balajee R., Srinivasadesikan V. and Ravi K. K. J. Mol. Str., 2023, 1273, 134250 (IF= 3.841) |
| 102 |
Metalated Porphyrin-Napthalimide Based Donor-Acceptor Systems with Long-lived Triplet States and Effective Three Photon Absorption Md Soif A., Chinmoy B., Botta B., Seelam P., Dipanjan B., Sudhansh K. N., Vipin K., Prabhakar Ch, Giribabu L., Soma V. R., and Raavi S. S. K. J. Photo Chem. Photo Biol. A Chemistry, 2022, 435, 114324 (IF= 5.141) |
| 101 |
Ultrafast Nonlinear Optical Studies of Polycyclic Aromatic Hydrocarbon (PAHs) based Benzo[b]naphtho[1,2,3,4-pqr] Perylene using Femtosecond Z-scan Sudhansh K. N., Md Soif A., Pola S., Dipanjan B., Soma V. R., Prabhakar Ch, and Raavi S. S. K. Frontiers in Optics + Laser Science, 2022, JTu4B.15 (Scopus) |
| 100 |
Synthesis of Titanates for Photomineralization of Industrial Wastewater and Organic pollutants. Ramesh G., Manohar B, Narendra Babu S., Ramadevi V., Someshwar P. and Prabhakar Ch.* Environ. Sci.: Water Res. Technol., 2022, 8, 3065-3078 (IF= 5.819) |
| 99 |
Single Crystal XRD, Spectroscopic, DFT Studies and Synthesis of [1,2,4]triazolo[4,3-a]pyrimidines Ravinder K., Raj Kamal, Vipin K. and Prabhakar Ch. Chem. Data Collect 2022, 42, 100949. |
| 98 |
2,4-Bis(2-(E)-arylidenehydrazinyl)quinazolines: Expeditious Synthesis, Characterization, Antiproliferative Effects Against Breast Cancer Cell Line and Molecular Docking Studies Ravinder K., Vipin K., Raj Kamal, Ajay K., Satwinderjeet K., Arubhi B and Prabhakar Ch. Chem. Select 2022, 7, e202202635 (IF= 2.307) |
| 97 |
Synthesis, Photophysical Properties and DFT Studies of Pyrrolo[1,2-a]quinoxaline Hosted Novel Hole Transporting Molecules for Perovskite Solar cell (PSC) Pratima S., Aniket K., Patil B. M., Prabhakar Ch. * and Atul C. J. Phys. Org. Chem., 2022, 35, e4424 (IF= 2.155) |
| 96 |
Benzo-dithiophene Based Donor-Acceptor-π-Donor-Acceptor System as Hole Transporting Materials for Efficient Perovskite Solar Cells M. Kishore, K. Ranjith, A. Meenakshamma, Ch. Prabhakar, S. Roy, V. D. Jadhav, S. N. Babu, G. Rambabu, M. Raghavender and S. Pola ChemPhotoChem, 2022, 6, e202200062 (IF= 3.679) |
| 95 |
Analysis of the spectral-luminescent properties of imidazo[1,2-b]pyrido[4,3-e][1,2,4]triazin-6(7Н)-ones. D. Y. Vandyshev, Kh. S. Shikhaliev, M. A. Prezent, O. A. Kozaderov, O. V. Ovechinnikov, M. S. Smirnov, T. N. Ilynova, D. A. Mangusheva, R. R. Iminova and Ch. Prabhakar Luminescence, 2022, 37, 1689-1700 (IF= 2.613) |
| 94 |
Ultrafast Intramolecular Charge Transfer Dynamics and Nonlinear Optical Properties of Phenothiazine based push-pull Zinc Porphyrin Chinmoy B., Gangadhar P. S., Giribabu L., Prabhakar Ch, Dipanjan B., Soma V. R., and Raavi S. S. K. J. Photo Chem. Photo Biol. A Chemistry, 2022, 433, 114141 (IF= 5.141) |
| 93 |
Femtosecond Third-Order Nonlinear Optical Properties of Unconstrained Green Fluorescence Protein Chromophores MD S. Ahmed, Chinmoy B., Dipanjan B., Prabhakar Ch, Yang J-S., Soma V. R., and Raavi S. S. K. Frontiers in Physics., 2022, 10, 914135 (IF= 3.718) |
| 92 |
Novel inhibitory composition based on 4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-7-ol derivatives for steel acid corrosion protection. A. A. Kruzhilin, D. S. Shevtson, A. Yu. Potapov, Kh. S. Shikhaliev, O. A. Kozaderov, Ch. Prabhakar and V. E. Kasatkin Int. J. Corros. Scale Inhib., 2022, 11, 774-795 (IF= Scopus) |
| 91 |
Photooxidation of 2,2′-(ethyne-1,2-diyl)dianilines; An Enhanced Photocatalytic Properties of New Salophen based Zn (II) Complexes Mahes S., Ramesh G., Prabhakar Ch* and Someshwar P Photochem., 2022, 2, 358-375 |
| 90 |
DFT and TDDFT Study on Optoelectronic Properties of Fused Heterocycles with Cyclooctatetraene Vipin K., Anuj T., Seyong C., Ramesh K. C., Ji-Youn S., Joonkyung J., Prabhakar Ch* Bull. Korean Chem. Soc., 2022, 43, 990-998 (IF= 1.241) |
| 89 |
Identification of novel quinazolinone hybrids as cytotoxic agents against C6 glioma cell lines Shankaraiah P., Bhavani A.K.D., Sumathi C., Ramakrishna K., Anwita M., Prakash B. P., Prabhakar Ch J. Chin. Chem. Soc., 2022, 69, 968-978 (IF= 1.753) |
| 88 |
Organic Materials based on Hetero Polycyclic Aromatic Hydrocarbons for Organic Thin- Film Transistors Applications Suresh K., Ramesh G.,Yadagiri B., Anuj T., Prabhakar Ch * and Someshwar P. Mater. Sci. Semicond. Process, 2022, 147, 106730 (IF= 4.644) |
| 87 |
Identification of Potential inhibitors for Hematopoietic Prostaglandin D2 Synthase: Computational Modeling and Molecular Dynamics Simulations Satyajit B. and Prabhakar Ch * J. Mol. Str., 2022, 1259, 132704 (IF= 3.841) |
| 86 |
Synthesis and Optical Properties of Mono- and Di-Substituted 1,3,5-Triazines Functionalized with Thiophene and Furan Vidya VM, Someswar P and Prabhakar Ch * J. Mol. Str., 2022, 1254, 132408 (IF= 3.841) |
| 85 |
Impact of internal (donor/acceptor) moieties and p-spacer in triphenylamine-based dyes for DSSCs Tripathi A., Vipin K. and Prabhakar Ch.* J. Photo Chem. Photo Biol. A Chemistry, 2022, 426, 113738 (IF= 5.141) |
| 84 |
Coronene-Embedded ‘Super’Coumarins Nitisha, Prabhakar Ch. and Venkatakrishnan P. Chem. Commun., 2022, 58, 431-434 (IF= 6.065) |
| 83 |
Function-oriented synthesis of fluorescent chemosensor for selective detection of Al3+ in neat aqueous solution: paperstrip detection & DNA bioimaging Gokul G., Pownthurai B., Niloufer K. K., Mukeshkumar Y., Prabhakar Ch., Atul C. J. Photo Chem. Photo Biol. A Chemistry, 2022, 425, 113699 (IF= 5.141) |
| 82 |
Stability, Optical and Charge Transport Properties of Saddle-shaped Cyclooctatetra-thiophene (COTh) isomers: A Theoretical study Tripathi A., Vipin K. and Prabhakar Ch.* J. Sulfur. Chem. 2022, 43, 180-192 (IF= 2.680) |
| 81 |
Design, synthesis and Characterization of Novel Benzothiadiazine-1,1-dioxide based organic material for OLED applications Jatin J. Lade, S-S Shiou, Y-H Tseng, M-H Chiu, Y-F Lin, C-H Chang, Prabhakar Ch., Atul C. Chem. Select 2021, 6, 11029-11038 (IF= 2.307) |
| 80 |
Ultrafast Excited State Relaxation Dynamics of Triphenylmethane Derivative Dye, New Fuchsine C. Biswas, S. V. Rao, Ch. Prabhakar and S. S. K. Raavi ChemPhysChem, 2021, 22, 2562-2572 (IF= 3.520) |
| 79 |
New [1,2,4]-triazolo-[1,5-a]-pyrimidine-7-one corrosion inhibitors for copper in chloride environment. A. A. Kruzhilin, D. V. Lyapun, D. S. Shevtson, O. A. Kozaderov, A. Yu. Potapov, I. D. Zartsyn, Ch. Prabhakar and Kh. S. Shikhaliev Int. J. Corros. Scale Inhib., 2021, 10, 1474-1492 (IF= Scopus) |
| 78 |
Efficient, Dopant free Phenazine based Hole Transporting Materials for High Performance Perovskite Solar Cells Ramesh G., Babu N. S., Prabhakar Ch, Someshwar P. and Raghavender M. Solar Energy, 2021, 226, 501-512 (IF= 7.188) |
| 77 |
New Zn (II) Complex-Composite Material: Piezo-Enhanced Photomineralization of Organic Pollutants and Wastewater from Lubricant Industry. Venkateshwar Rao D., Mahesh S., Ramesh G., Manohar B, Prabhakar Ch., Narendra Babu S., Penumaka N., Yadagiri B. and Someshwar P Environ. Sci.: Water Res. Technol., 2021, 7, 1737-1747 (IF= 5.819) |
| 76 |
New indolo[1,2-c]quinazolines for Single-crystal field effect transistor (SCFET): A united Experimental and Theoretical Studies. Venkat Swamy P., Suresh K., Yadagiri B., Anuj T., Prabhakar Ch. *, Anindita C.*, Kiran K. V.* and Someshwar P* J. Phys. Org. Chem., 2021, 34, e4276 (IF= 2.155) |
| 75 |
Carbazole-pyridine pyrroloquinoxaline/benzothiadiazine 1,1-dioxide based bipolarhosts for efficient red PhOLEDs. Bhausaheb P., Pownthurai B., Shian-Sung C., Wei-Ling C., Dun-Cheng H., Yogesh J., Prabhakar Ch.,*, Chih-Hao C.,*, Atul C.* Org. Electron, 2021, 96 106217 (IF= 3.868) |
| 74 |
Synthesis of New Zn (II) Complexes for Photo decomposition of Organic Dye Pollutants,Industrial Wastewater and Photo-oxidation of methyl Arenes under Visible-light. Jakeer A., Jakeer P., Venkateshwar Rao D., Ranjith K., Ramesh G., Yadagiri B., Prabhakar Ch. and Someshwar P. J. Photo Chem. Photo Biol. A Chemistry, 2021, 419,113455 (IF= 5.141) |
| 73 |
New copper corrosion inhibitors in chloride environments based on benzo-[1,2,4]-triazolo-[1,5-a]-pyrimidine-6-carboxylates. A. A. Kruzhilin, V. A. Polikarchyuk, O. A. Kozaderov, Kh. S. Shikhaliev, D. S. Shevtson, A. Yu. Potapov, I. D. Zartsyn, and Ch. Prabhakar Int. J. Corros. Scale Inhib., 2021, 10, 732-748 (IF= Scopus) |
| 72 |
Carbazole/triphenylamine-cyanobenzimidazole hybrid bipolar host materials for green phosphorescent organic light-emitting diodes. Bhausaheb P., Jatin L., Shian-Sung C., Yen-Chia C., Yogesh J., Prabhakar Ch.,*, Chih-Hao C.,*, Atul C.* Org. Electron, 2021, 92 106090 (IF= 3.868) |
| 71 |
Combined Experimental and DFT studies on Novel 9-(4/3/2-Cyanophenyl)-9H-Carbazole-3-Carbonitrile Compounds for Organic Electronics. Bhausaheb P., Jatin L., Pratima S., Anuj T., Prabhakar Ch.,*, Yogesh J.,*, Atul C.* J. Phys. Org. Chem., 2021, 34, e4207 (IF= 2.155) |
| 70 |
New copper corrosion inhibitors in chloride environments based on benzo-[1,2,4]-triazolo-[1,2]-triazinones. D. S. Shevtson, M. N. M. Mawlood, O. A. Kozaderov, Kh. S. Shikhaliev, A. A. Kruzhilin, A. Yu. Potapov, I. D. Zartsyn, and Ch. Prabhakar Int. J. Corros. Scale Inhib., 2021, 10, 228-244 (IF= Scopus) |
| 69 |
A DFT study on electronic excitations, charge transfer and NLO Properties of visible absorbing squaraine and thiosquaraine dyes. Prabhakar Ch.,*, Tripathi A., Ritu M., Atul C. Indian J. Chem. A 2021, 60A, 370-377 (IF= 0.412) |
| 68 |
Effective Photodegradation of Organic Pollutants in the Presence of Mono and Bi-metallic complexes under Visible-Light Irradiation. Mahesh S., Ramesh G., Venkanna G., Prabhakar Ch., Koteshwar Rao R. and Someshwar P. J. Photo Chem. Photo Biol. A Chemistry, 2021, 406, 112996 (IF= 5.141) |
| 67 |
New Indolo[3,2-b]indoles based small organic molecules for Organic Thin Film Transitors (OTFTs): A Combined Experimental and DFT Study. Venkat S. P., Mahesh S., Bhongiri Y., Anuj T., K. R. S. Prasad,b Anindita C.,* Someshwar P.* and Prabhakar Ch*. J. Mol. Str., 2021, 1229, 129491 (IF= 3.841) |
| 66 |
Optoelectronic and Charge Transport Properties of D-n-A type 1,3,5-Triazine Derivatives: A combined experimental and DFT study. Vidya V. M., Pola. S and Prabhakar Ch*. Spectrochimica Acta Part A, 2021, 245, 118940 (IF= 4.831) |
| 65 |
Impact of polycyclic aromatic hydrocarbons and heteroatomic bridges (N, S, and O) on optoelectronic properties of 1,3,5-triazine derivatives: A computational insight. Vidya V. M. and Prabhakar Ch*. J. Phys. Org. Chem., 2021, 34, e4128 (IF= 2.155) |
| 64 |
Diacetoxy iodobenzene mediated regioselective synthesis and characterisation of novel [1,2,4]triazolo[4,3-a]pyrimidines:Apoptosis inducer, antiproliferative activities and molecular docking studies R. Kamal, R. Kumar, V. Kumar, J. K. Bhardwaj, P. Saraf, A. Kumar, K. Pandit, S. Kaur, Ch. Prabhakar and S.Beura J. Biomol. Struct. Dyn., 2021, 39, 4398-4414 (IF= 5.231) |
| 63 |
In-silico strategies for probing chloroquine based inhibitors against SARS-CoV-2 Satyajit Beura and Prabhakar Ch * J. Biomol. Struct. Dyn., 2021, 39, 3747-3759 (IF= 5.231) |
| 62 |
3-Alkyl-5-amino-1,2,4-triazoles synthesized from the fatty acids of sunflower oil processing waste as corrosion inhibitors for copper in chloride environments. D. S. Shevtson, Kh. S. Shikhaliev, N. V. Stolpovskaya, A. A. Kruzhilin, A. Yu. Potapov, I. D. Zartsyn, O. A. Kozaderov, D. V. Lyapun, C. Prabhakar and A. Tripathi Int. J. Corros. Scale Inhib., 2020, 9, 726-744 (IF= Scopus) |
| 61 |
Novel variants of the multicomponent reaction for the synthesis of 1,2,4-triazolo[1,5-а]pyrimidines and pyrido[3,4-е][1,2,4]triazolo[1,5- а]pyrimidines. Vladimir А. P., Yuliya V. C., Andrei Yu. P., Irina V. L., Yevgeniya А. K., Mikhail Yu. K.*,Oleg А. K., Gennadiy V. S., Dmitriy Yu. V., Khidmet S. S., Prabhakar. Ch* Chemistry of Heterocyclic Compounds, 2020, 56, 1054-1061 (IF= 1.519) |
| 60 |
Influence of Internal Acceptor and Thiophene Based π-spacer in D-A-π-A System on Photophysical and Charge Transport Properties for efficient DSSCs: A DFT Insight.. Tripathi A., Ganjoo A. and Prabhakar Ch*. Solar Energy, 2020, 209, 194-205 (IF= 7.188) |
| 59 |
Linear and Non-Linear Optical Characteristics of Some 1,3,5-Triazines Influenced by Prototropic Tautomerism: A DFT Study. Vidya V. M. and Prabhakar Ch*. Opt. Mater., 2020, 109, 110365 (1-9) (IF= 3.754) |
| 58 |
Inhibition of Copper Corrosion with N-Arylaminotriazoles in Aqueous Chloride Solutions and in Air. D. S. Shevtsov, Kh. S. Shikhaliev,*, E. S. Komarova, A. A. Kruzhilin, G. O. Kipriyanova, A. Yu. Potapov, I. D. Zartsyn, O. A. Kozaderov, Ch. Prabhakar, and A. Tripathi. Russian Journal of Applied Chemistry, 2020, 93, 1152-1159 (IF= 0.850) |
| 57 |
Cost effective thiophene assisted novel dopant-free hole transport materials for efficient perovskite solar cell performance M. SasiKumar, M. Gurulakshmi, A. Meenakshamma, S. Mahesh, V. J. Rao, S. N. Babu, C. Prabhakar, M. Raghavender and P. Someshwar Sustain. Energy Fuels, 2020, 4, 4754-4767 (IF= 6.813) |
| 56 |
Identification of potential human COX-2 inhibitors using computational modeling and molecular dynamics simulations Satyajit Beura and Prabhakar Ch * J. Mol. Str., 2020, 1216, 128271 (IF= 3.196) |
| 55 |
Enhanced Charge Transport Properties in Heteroatomic (NH, O, Se) Analogs of Benzotrithiophene (BTT) isomers: A DFT insight A. Tripathi and Ch. Prabhakar* Mol. Simulat., 2020, 46, 548-556 (IF= 2.346) |
| 54 |
Effect of Fluorine on Optoelectronic Properties in DI-A-DII-A-DI type Organic Molecules: A combined experimental and DFT study E. Appalanaidu, V. M. Vidya, B. M. Reddy, J. R. Vaidya and Prabhakar Ch * J. Mol. Str., 2020, 1210, 12809 (1-10) (IF= 3.841) |
| 53 |
Substitution Tuned Electronic Absorption,Charge Transfer and Non-linear Optical Properties of some D-A Type 2,4,6-Trisubstituted-1,3,5-Triazines: A DFT Study Vidya V. M. and Ch. Prabhakar* B. Mater. Sci., 2020, 43:80 (1-11) (IF= 1.783) |
| 52 |
A DFT study on optical, electronic and charge transport properties of star-shaped Benzo[1,2-b:3,4-bʹ:5,6-b]trithiophene oligomers A. Tripathi, O. Kozaderov, K. Shikhaliev and Ch. Prabhakar* J. Phys. Org. Chem., 2020, 33, e4037 (1-9) (IF= 2.155) (Cover page article) |
| 51 |
Optical and Charge Transport Properties in Chalcogen (O, S and Se) based acene molecules A. Tripathi and Ch. Prabhakar* J. Mol. Str. 2020, 1203, 127397 (1-8) (IF= 3.841) |
| 50 |
Structural assessment and identification of 11β-hydroxysteroid dehydrogenase type 1 inhibitors A. Ganjoo , A. Tripathi and Ch. Prabhakar* J. Biomol. Struct. Dyn., 2020, 38, 4928-4937 (IF= 5.231) |
| 49 |
A DFT Probe on the Linear and Non-Linear Optical Characteristics of some Star Shaped DI-π-DII-A type Acetylene Bridged Rigid Triazines Vidya V. M. and Ch. Prabhakar* J. Phys. Org. Chem., 2020, 33, e4027 (1-10) (IF= 2.155) |
| 48 |
3-sulphinyl-5-amino-1H-1,2,4-triazoles as inhibitors 2 of copper corrosion D. Shevtsov, O. Kozaderov, K. Shikhaliev, E. Komarova, A. Kruzhilin, A. Potapov, Ch. Prabhakar and, I. Zartsyn Applied Sciences 2019, 9 , 4882 (1-14) (IF= 2.838) |
| 47 |
Copper corrosion inhibition in chloride environments by 3-(N-hetaryl)-5-amino-1H-1,2,4- Triazoles O.A. Kozaderov, Kh.S. Shikhaliev*, Ch. Prabhakar*, D.S. Shevtsov, A.A. Kruzhilin, E.S. K omarova, A.Yu. Potapov and I.D. Zartsyn Int. J. Corros. Scale Inhib., 2019, 8, 422-436 (IF= Scopus) |
| 46 |
A coumarin-benzothiazole derivative as a FRET3 based chemosensor of adenosine 5’-triphosphate M. T. Gabr, M. M. H. Ibrahim, A. Tripathi and Ch. Prabhakar Chemosensors, 2019, 7, 34 (1-11) (IF= 4.229) |
| 45 | A very Fast Photodegradation of Dyes in the Presence ofNew Schiff’s Base N4-Macrocyclic Ag-doped Pd(II) Complexes under Visible-Light Irradiation
G. Venkanna, A. Jakeer, S. Mahesh, G. V. Charan, Ch. Prabhakar and S. Pola J. Photo Chem. Photo Biol. A Chemistry, 2019, 382, 111975 (1-9) (IF= 5.141) |
| 44 |
Corrosion of α-Brass in Solutions Containing Chloride Ions and 3-Mercaptoalkyl-5-amino-1H-1,2,4-triazoles O. Kozaderov, K. Shikhaliev, Ch. Prabhakar, A. Tripathi, D. Shevtsov, A. Kruzhilin, E. Komarova, A. Potapov, I. Zartsyn and Y. Kuznetsov Applied Sciences 2019, 9 , 2821 (1-15) (IF= 2.838) |
| 43 |
Linear and Femtosecond Nonlinear Optical Properties of Soluble Pyrrolo[1,2-a] Quinoxalines C. Biswas, K. N. Krishnakanth, J. J. Lade, A. C. Chaskar, A. Tripathi, Ch. Prabhakar, S. V. Rao and S. S. K. Raavi Chem. Phys. Lett. 2019, 730, 638- 642 (IF= 2.719) |
| 42 |
Low cost ‘green’ dye sensitized solar cells based on New Fuchsin dye withaqueous electrolyte and platinum-free counter electrodes K. K. Ramesh, S. Bhattacharya, L. S. Cardoso, P. B. Miranda, S. V. Rao, Ch. Prabhakar, D. Melepurath and S. S. K. Raavi Solar Energy 2019, 188, 913-923 (IF= 7.188) |
| 41 |
Evolution of Physical and Photocatalytic Properties of New Zn(II) and Ru(II) complexes V. Gugulothu, J. Ahemed, M. Subburu, B. Yadagiri, R. Mittal, Ch. Prabhakar and S.Pola Polyhedron 2019, 170, 412-423 (IF= 2.975) |
| 40 |
In silico structural anatomization of spleen tyrosine kinase inhibitors: Pharmacophore modeling, 3D QSAR analysis and molecular docking studies A. Ganjoo and Ch. Prabhakar* J. Mol. Str. 2019, 1189, 102-111 (IF= 3.841) |
| 39 |
Optoelectronic and Charge Transport Properties of Truxene, Isotruxene and its Heteroatomic (N, O, Si and S) analogs: A DFT Study A. Tripathi and Ch. Prabhakar*. J. Phys. Org. Chem., 2019, 32, e3944 (1-9) (IF= 2.155) |
| 38 |
Eco-friendly synthesis, crystal structures, photophysical properties and DFT studies of new N-arylthiazole-5-carboxamides J. Miryala, A. Tripathi, Ch. Prabhakar, D. Sarma, S. Pola, B. Satyanarayana J. Mol. Str. 2019, 1184, 193-199 (IF= 3.841) |
| 37 |
Optoelectronic properties of benzotrithiophene isomers: A density functional theory study A. Tripathi and Ch. Prabhakar* J. Chin. Chem. Soc., 2019, 66, 891-898 (IF= 1.753) |
| 36 |
Impact of heteroatom (S and N) position and change in central ring of anthracene with heterocyclic ring on charge transport and optical properties in anthratetrathiazole (ATTz) A. Tripathi and Ch. Prabhakar* J. Sulfur. Chem. 2019, 40, 361-376 (IF= 2.680) |
| 35 |
Linear, Non-linear Optical Properties and Reorganization energies of D- π-A star shaped Triazine Derivatives: A DFT Study V. M. Vidya, A. Tripathi and Ch. Prabhakar* J. Mol. Str. 2019, 1176, 855-864 (IF= 3.841) |
| 34 |
Triazolopyridine hybrids as bipolar host materials for green phosphorescent organic light-emitting diodes (OLEDs) K. S. Vadagaonkar, C-J. Yang, W-H. Zeng,J-H. Chen, B. N. Patil, Ch. Prabhakar, L-Y. Chen and A. C. Chaskar Dyes and Pigments 2019, 160, 301-314 (IF= 5.122) |
| 33 |
Pyrrolo[1,2-a]quinoxaline based bipolar host materials for efficient red phosphorescent OLEDs B. N. Patil, J. J. Lade, K. S. Vadagaonkar, Ch. Prabhakar and A. C. Chaskar Chem. Select 2018, 3, 10010-10018 (IF= 2.307) |
| 32 |
Dicyanomethylene substituted oxocarbon dianions: A comparative computational study Promila, A. Tripathi and Ch. Prabhakar* Indian J. Chem. A 2018, 57A, 1121-1127 (IF= 0.412) |
| 31 |
Impact of replacement of central benzene ring in Anthracene by Heterocyclic ring on Electronic excitations and Reorganization energies in Symmetrical Anthratetrathiophene (ATT) molecule A.Tripathi and Ch. Prabhakar* J. Chin. Chem. Soc., 2018, 65, 918-924 (IF= 1.753) |
| 30 |
Mono-, Di- and Tri- substituted S-triazine as anticancer agents: A comparative molecular docking study A. P. Joshi, A. Tripathi and Ch. Prabhakar* Indian J. Chem. B 2018, 57B, 816-822 (IF= 0.0.456) |
| 29 |
A Comparative Computational study of C-N and C-C bonding visible to NIR absorbing Croconines. A. Tripathi and Ch. Prabhakar* J. Mol. Str. 2018, 1155, 561-567 (IF= 3.841) |
| 28 |
Visible to NIR absorbing C-N and C-C bonding Squaraines: A computational study. A. Tripathi, Promila and Ch. Prabhakar*. J. Phys. Org. Chem., 2018, 31, e3758 (IF= 2.155) |
| 27 |
Iron Catalyzed Cascade Protocol for the Synthesis of Pyrrolo[1,2-a]quinoxalines: A Powerful Tool to Access Solid State Emissive Organic Luminophores. Jatin J. Lade, Bhausaheb N. Patil, Pratima A. Sathe, Kamlesh V. Vadagaonkar, Ch. Prabhakar, Atul C. Chaskar Chem. Select 2017, 2, 6811-6817 (IF= 2.307) |
| 26 |
Visible absorbing croconium dyes with intramolecular hydrogen bonding: A combined experimental and computational study Ch. Prabhakar*, Promila, A. Tripathi, K. Bhanuprakash and V. J. Rao J. Mol. Str. 2017, 1146, 684-691 (IF= 3.841) |
| 25 |
Redox-Gated Tristable Molecular Brakes of Geared Rotation T. Tseng, H-F Lu, C-Y Kao, C-W Chiu, I Chao, Ch. Prabhakar, and J-S Yang J. Org. Chem., 2017, 82, 5354–5366 (IF= 4.198) |
| 24 |
Visible absorbing symmetrical squaraine and croconine dye derivatives: A comparative computational study A. Tripathi, Promila and Ch. Prabhakar*. J. Phys. Org. Chem., 2017, 30, e3673 (IF= 2.155) (Cover page article) |
| 23 |
Optical absorption and electronic properties of 4-amino antipyrine schiff’s bases: A combined experimental and DFT study. B. Anupama, A. Aruna, A. Tripathi and Ch. Prabhakar*. J. Mod. Chem. Chem. Tech. 2017, 8, 1-13. |
| 22 |
Synthesis of New Fused Heterocyclic Aromatic Hydrocarbons via C-S and C-C bonds formation by C-H Bond Activation in the Presence of New Pd(II) Schiff’s Base Complexes S. Pola, Y. Bhongiri, R. Jadhav, Ch. Prabhakar and G. Venkanna. RSC Adv., 2016, 6, 88321–88331 (IF= 4.036) |
| 21 |
DABCO-catalyzed one-pot three component synthesis of dihydropyrano[3,2-c]chromene substituted quinazolines and their evaluation towards anticancer activity. S. Vodnala, A. K. D. Bhavani, R. Kamutam , V. G. M. Naidu, Promila and Ch. Prabhakar. Bioorg. Med. Chem. Lett. 2016, 26, 3973–3977 (IF= 2.940) |
| 20 |
Light-Gated Molecular Brakes Based on Pentiptycene-Incorporated Azobenzenes. W- S Tan, P-Y Chuang, C-H Chen, Ch. Prabhakar, S-J Huang, S-L Huang, Y- H. Liu, Y-C Lin, S-M Peng and J- S. Yang. Chem. Asian J. 2015, 10, 989-997 (IF= 4.839) |
| 19 |
Enhanced Molecular First Hyperpolarizability in s-Triazine Derivatives: Combined Experimental and Computational Studies. K. Srinivas, Ch. Prabhakar*, S. Sitha, K. Bhanuprakash and V. J. Rao. J. Mol. Str. 2014, 1075, 118- 123 (IF= 3.841) |
| 18 |
Effects of Iptycene Scaffolds on the Photoluminescence of N,N-Dimethyl- aminobenzonitrile and Its Analogues. W- S Tan, Ch. Prabhakar, Y- H. Liu, S-M. Peng and J- S. Yang Photo Chem. Photo Biol. Sci., 2014, 13, 211-223 (IF= 3.982) |
| 17 |
Light- and Redox- Gated Molecular Brakes Consisting of a Pentiptycene Rotor and an Indole Pad. C-Y. Kao, I-T. Lee, Ch. Prabhakar, and J-S. Yang J. Chin. Chem. Soc., 2014, 61, 507-516 (IF= 1.753) (Cover page article) Selected as Best Articles Award for the year 2014 |
| 16 |
Effects of Hydrogen Bonding on Internal Conversion of GFP-like Chromophores: I. The para-Amino Systems. G-J. Huang, C-W. Cheng, H-Y. Hsu, Ch. Prabhakar, Y-P. Lee, E. W-G. Diau and J-S. Yang J. Phys. Chem. B 2013, 117, 2695- 2704 (IF= 3.466) |
| 15 |
Effects of Hydrogen Bonding on Internal Conversion of GFP-like Chromophores: II. The meta-Amino Systems. C-W. Cheng, G-J. Huang, H-Y. Hsu, Ch. Prabhakar, Y-P. Lee, E. W-G. Diau and J-S. Yang J. Phys. Chem. B 2013, 117, 2705- 2716 (IF= 3.466) |
| 14 |
A comparative Study of Semi-Squaraine and Squaraine Dyes UsingComputational Techniques: Tuning the Charge Transfer /Biradicaloid Character by Substitution. A. L. Puyad, G. K. Chaitanya , Ch. Prabhakar and K. Bhanuprakash J. Mol. Model. 2013, 19, 275- 287 (IF= 1.810) |
| 13 |
Site-Selective Hydrogen-Bonding Induced Fluorescence Quenching of Highly Solvatofluorochromic GFP like Chromophores. G-J. Huang, J-H. Ho, Ch. Prabhakar, Y-H. Liu, S-M. Peng and J-S. Yang Org. Lett. 2012, 14, 5034- 5037 (IF= 6.072) |
| 12 |
Star-Shaped Oligothiophenes Containing an Isotruxene Core: Synthesis,Electronic Properties, Electropolymerization, and Film Morphology. T-A. Liu, Ch. Prabhakar, J-Y. Yu, C-H. Chen, H-H. Huang, and J-S. Yang Macromolecules. 2012, 45, 4529- 4539 (IF= 6.057) |
| 11 |
Ortho-Branched Ladder-Type Oligophenylenes with Two-Dimensionally π- Conjugated Electronic Properties. H-H. Huang, Ch. Prabhakar, K-C. Tang, P-T. Chou, G-J. Huang, and J-S. Yang J. Am. Chem. Soc. 2011, 133, 8028–8039 (IF= 16.383) |
| 10 |
A Redox-Gated Slow-fast-stop Molecular Rotor. C-H. Yang, Ch. Prabhakar, S-L. Huang, Y-C. Lin, W- S. Tan, N. C. Misra, W-T. Sun, and J-S. Yang Org. Lett. 2011, 13, 5632-5635 (IF= 6.072) |
| 09 |
Ortho-Amino Conjugation Effect on the Photochemistry of trans-Aminostilbenes. C-K. Lin, Ch. Prabhakar, and J-S. Yang J. Phys. Chem. A 2011, 115, 3233–3242 (IF= 2.944) |
| 08 |
Third Order Nonlinear Optical Properties of Squaraine dyes having absorption below 500 nm: A Combined Experimental and Theoretical Investigation of Closed shell Oxyallyl Derivatives. Ch. Prabhakar, K. Bhanuprakash, V. J. Rao, M. Balamuralikrishna, and D. N. Rao J. Phys. Chem. C 2010, 114, 6077- 6089 (IF= 4.177) |
| 07 |
High Level Computational Studies of Rhodizonate Derivatives: Molecules Absorbing in Near Infrared Region Due to Larger C-C-C Angle of the Oxyallyl Ring. A. L. Puyad, Ch. Prabhakar, K. Yesudas, K. Bhanuprakash and V. J. Rao J. Mol. Str., (THEOCHEM) 2009, 904, 1- 6 (IF= 1.549) |
| 06 |
Linear and Nonlinear Optical Properties of Mesoionic Oxyallyl Derivatives: Enhanced Non-Resonant Third Order Optical Nonlinearity in Croconate Dyes. Ch. Prabhakar, K. Yesudas, K. Bhanuprakash, V. J. Rao, R. S. S. Kumar and D.N. Rao J. Phys. Chem. C 2008, 112, 13272- 13280 (IF= 4.177) |
| 05 |
Estimation of the first excitation energy in diradicaloid croconate dyes having absorption in the near infra red (NIR): A DFT and SF-TDDFT study. A. Thomas, K. Srinivas, Ch. Prabhakar, K. Bhanuprakash, and V. J. Rao Chem. Phys. Lett. 2008, 454, 36- 41 (IF= 2.719) |
| 04 |
Enhanced Diradical Nature in Oxyallyl Derivatives Leads to Near Infra Red Absorption: A Comparative Study of the Squaraine and Croconate Dyes Using Computational Techniques. |
| 03 | Structure, Bonding, and Lowest Energy Transitions in Unsymmetrical Squaraines: A Computational Study. K. Yesudas, G. K. Chaitanya, Ch. Prabhakar, K. Bhanuprakash, and V. J. Rao J. Phys. Chem. A 2006, 110, 11717- 11729 (IF= 2.944) |
| 02 | Near Infrared Absorption in Symmetric Squarailium and Croconate Dyes: A Comparative Study Using Symmetry Adopted Cluster Configuration
Interaction Methods. |
| 01 | Role of oxyallyl substructure in the near infrared (NIR) absorption in symmetrical dye derivatives: A computational study. Ch. Prabhakar, G. K. Chaitanya, S. Sitha, K. Bhanuprakash, and V. J. Rao. J. Phys. Chem. A 2005, 109, 2614- 2622 (IF= 2.944) |
Conferences/ Symposia Organized:
Professional recognition, awards, fellowships received:
Responsibilities at Institute/ Department level:
