Computational Chemistry Group @ Central University of Gujarat (CCG@CUG)
PRESENT Ph.D. STUDENTS
Aakanksha Kunwar
Joined lab: September, 2023
PhD Topic of Research: Computer-Aided Drug Designing
Academic Background:
M.Sc. in Chemical Sciences from Central University of Gujarat, Gandhinagar (2021-2023)
PhD Topic of Research: Computer-Aided Drug Designing
Academic Background:
M.Sc. in Chemical Sciences from Central University of Gujarat, Gandhinagar (2021-2023)
Arzoo Rai
Joined lab: September, 2023
PhD Topic of Research: Quantum Computational Chemistry
Academic Background:
M.Sc. in Industrial Chemistry from Central University of Gujarat, Gandhinagar (2020-2022)
PhD Topic of Research: Quantum Computational Chemistry
Academic Background:
M.Sc. in Industrial Chemistry from Central University of Gujarat, Gandhinagar (2020-2022)
Gondaliya Krishna Narendrakumar
Joined lab: September, 2023
PhD Topic of Research: Computer-Aided Drug Designing
Academic Background:
M.Sc. in Chemistry from Kadi Sarva Vishwavidyalaya
PhD Topic of Research: Computer-Aided Drug Designing
Academic Background:
M.Sc. in Chemistry from Kadi Sarva Vishwavidyalaya
Suruchi Bhambri
Joined lab: September, 2023
PhD Topic of Research: Computer-Aided Drug Designing
Academic Background:
M.Sc. in Industrial Chemistry from Central University of Gujarat, Gandhinagar (2021-2023)
PhD Topic of Research: Computer-Aided Drug Designing
Academic Background:
M.Sc. in Industrial Chemistry from Central University of Gujarat, Gandhinagar (2021-2023)
ALUMINI
Ph.D. STUDENTS
AMAR GHOSH
PhD Thesis Title: Exploration of Novel Potential Anti-Cancer Compounds against Cyclin Dependent Kinase: An in silico Studies
Year Joined: August, 2018
Year Completed: December, 2023
Current Address: Postdoctoral Research Associate in JNCASR, Bengaluru
Year Joined: August, 2018
Year Completed: December, 2023
Current Address: Postdoctoral Research Associate in JNCASR, Bengaluru
Mohsin Yousuf Lone
PhD Thesis Title: Deciphering the Biological Questions of Mycobacterium tuberculosis: An In-silico Insight
Year Joined: July, 2012
Year Completed: June, 2018
Current Address: Postdoctoral Research Associate in IITGn
Year Joined: July, 2012
Year Completed: June, 2018
Current Address: Postdoctoral Research Associate in IITGn
Showkat Hassan Mir
PhD Thesis Title: A Computational Study of Structural, Electronic and Phonon Properties of some Bulk and Low Dimensional Materials
Year Joined: July, 2012
Year Completed: Jan, 2018
Current Address: Postdoctoral Fellow in IITK
Year Joined: July, 2012
Year Completed: Jan, 2018
Current Address: Postdoctoral Fellow in IITK
Prabodh ranjan
PhD Thesis Title: Rational Approach to Design Imidazole based Ionic Liquids as Anthelmintic Leads
Year Joined: July, 2014
Year Completed: Jan, 2019
Current Address: Postdoctoral Fellow in IITM
Year Joined: July, 2014
Year Completed: Jan, 2019
Current Address: Postdoctoral Fellow in IITM
Haamid Rasool Bhat
PhD Thesis Title: Molecular Anion Sensors: A Computational Approach
Year Joined: July, 2013
Year Completed: March, 2018
Current Address: Nehru-Postdoctoral Research fellow in CSMCRI, Bhavnagar
Year Joined: July, 2013
Year Completed: March, 2018
Current Address: Nehru-Postdoctoral Research fellow in CSMCRI, Bhavnagar
Mohd Athar
PhD Thesis Title: In-silico study of structural, energetics and biological properties of Calixarene derivatives
Year Joined: July, 2013
Year Completed: Oct, 2019
Current Address: Postdoctoral Fellow in InStem, NCBS, Bengaluru
Year Joined: July, 2013
Year Completed: Oct, 2019
Current Address: Postdoctoral Fellow in InStem, NCBS, Bengaluru
ANU MANHAS
POSTDOCTORAL FELLOW
Prashant S Kumar
DBT-RA fellow in the group
He has completed his PhD from Gujarat University, Ahmedabad
Current Position: IISC Bangalore
He has completed his PhD from Gujarat University, Ahmedabad
Current Position: IISC Bangalore
M.SC. STUDENTS
2023-2024
Ritam Das
Ritam Das
2022-2023
Riya
The in silico investigation of Novel Anti-Cancer Compounds against Cyclin Dependent Kinase 4/6
Suruchi Bhambri
Computational Investigation of Noval Anti-Cancer Compounds Targeting Cyclin Dependent Kinase 5
Riya
The in silico investigation of Novel Anti-Cancer Compounds against Cyclin Dependent Kinase 4/6
Suruchi Bhambri
Computational Investigation of Noval Anti-Cancer Compounds Targeting Cyclin Dependent Kinase 5
2021-2022
Arzoo Rai
Structure-Based in silico studies to search for the potential inhibitors against CDK1 enzyme
Baishali Paul
Influence of heteroatom substitution on NTS molecule: A DFT/ TD-DFT outlook
Samudro Ghosh
Excited state Intramolecular Proton Transfer and Aromaticity of 2,2’-bipyridyl-3,3’-diol-5,5’-dicarboxylic acid ethyl ester (BP(OH)2DCEt): A DFT/TD-DFT Study
Semanty Pramanick
Identification of potential CDK5 inhibitors based on both ligand and structure based virtual screening along with molecular docking
Shreya Mukherjee
Discovery of Novel Potent Inhibitors for Cyclin-Dependent Kinase 9 (CDK9) Proteome Class Having Anti-Cancer Efficacy: An Insilico Analysis
Arzoo Rai
Structure-Based in silico studies to search for the potential inhibitors against CDK1 enzyme
Baishali Paul
Influence of heteroatom substitution on NTS molecule: A DFT/ TD-DFT outlook
Samudro Ghosh
Excited state Intramolecular Proton Transfer and Aromaticity of 2,2’-bipyridyl-3,3’-diol-5,5’-dicarboxylic acid ethyl ester (BP(OH)2DCEt): A DFT/TD-DFT Study
Semanty Pramanick
Identification of potential CDK5 inhibitors based on both ligand and structure based virtual screening along with molecular docking
Shreya Mukherjee
Discovery of Novel Potent Inhibitors for Cyclin-Dependent Kinase 9 (CDK9) Proteome Class Having Anti-Cancer Efficacy: An Insilico Analysis
2019-2020
Sujeet Kumar
Dissertation title: Role of Molecular Docking in Drug Design: Using Plasmepsin-II Enzyme as a Test Case
Garasiya Jagdish Basantlal
Dissertation title: Role of Pharmacophore Modeling in Drug Design: Using Plasmepsin-II Enzyme as a Test Case
Vishal Prajapati
Dissertation title:
Sujeet Kumar
Dissertation title: Role of Molecular Docking in Drug Design: Using Plasmepsin-II Enzyme as a Test Case
Garasiya Jagdish Basantlal
Dissertation title: Role of Pharmacophore Modeling in Drug Design: Using Plasmepsin-II Enzyme as a Test Case
Vishal Prajapati
Dissertation title:
2018-2019
Saikat Dubey
Dissertation title: A computational study on the exploration of natural product inhibitors against P. falciparum orotidine-5-monophosphate decarboxylase enzyme
Sourab Mal
Dissertation title: Correlation Pka with energetics and QM charges: An Ab initio and DFT studies
Saikat Dubey
Dissertation title: A computational study on the exploration of natural product inhibitors against P. falciparum orotidine-5-monophosphate decarboxylase enzyme
Sourab Mal
Dissertation title: Correlation Pka with energetics and QM charges: An Ab initio and DFT studies
2017-2018
Akshita Goel
Dissertation title: Exploration of natural compounds inhibitors against Plasmodium falciparum plasmepsin: A computational Approach
Soubhik Das
Dissertation title: Conformational Equilibrium Study of calix[4]tetraloranes using Density Functional Theory and Molecular Dynamics Simulations
Akshita Goel
Dissertation title: Exploration of natural compounds inhibitors against Plasmodium falciparum plasmepsin: A computational Approach
Soubhik Das
Dissertation title: Conformational Equilibrium Study of calix[4]tetraloranes using Density Functional Theory and Molecular Dynamics Simulations
2015-2016
Satyaki Mukherjee
Dissertation title: Combined Structure based and Ligand Based 3D-QSAR Pharmacophore Virtual Screening For Designing Novel Akt2 (PKB-β) Inhibitors
Raunak Soni
Dissertation title: Targeting the folate reductase pathway of Malaria and Leishmaniasis: An In-Silico Approach
Satyaki Mukherjee
Dissertation title: Combined Structure based and Ligand Based 3D-QSAR Pharmacophore Virtual Screening For Designing Novel Akt2 (PKB-β) Inhibitors
Raunak Soni
Dissertation title: Targeting the folate reductase pathway of Malaria and Leishmaniasis: An In-Silico Approach
2014-2015
Dhara Aervadiya
Urvashi Dalsania
Kishan Dalsania
Ankita Singh
Dhara Aervadiya
Urvashi Dalsania
Kishan Dalsania
Ankita Singh
2013-2014
Vipin Singh
Biswajit Mohanty
Vipin Singh
Biswajit Mohanty
2012-2013
Abha Vyas
Bavesh Ahir
Abha Vyas
Bavesh Ahir