List of Publications

2018 2017 2016 2015 2014 2013 2012 2011 2010 2009 2008 2007 2006 2005 2004 2003 2002 2001 2000 Prior to 2000 Selected Publications

2019

224) Probing the Role of Imidazopyridine and Imidazophosphorine Scaffolds To Design Novel Proton Pump Inhibitor for H+,K+-ATPase: A DFT Study.Kalyanashis Jana, Shibaji Ghosh, Padmaja D Wakchaure, Tusar Bandyopadhyay, Bishwajit Ganguly. ACS Omega, 2019, 4 (1), pp 1311–1321.DOI: 10.1021/acsomega.8b02756

223) Tuning the ring strain effect in acridine derivatives on binding affinity with G-quadruplex-DNA: A computational and experimental study. MK Si, SK Pramanik, B Ganguly. International journal of biological macromolecules 124, 1177-1185. DOI.org/10.1016/j.ijbiomac.2018.12.019

222) 2-Amino-pentanoic acid and 1-Pyridiniumylacetate are new additives to generate distinct morphs of salt crystals: A combined computational and experimental study MK Si, SK Pramanik, V Hingu, B Ganguly Journal of Molecular Structure 1175, 728-733. doi.org/10.1016/j.molstruc.2018.08.024


2018

221) Fluorescent chemodosimeter for quantification of cystathionine-c-synthase activity in plant extracts and imaging of endogenous biothiols. Hridesh Agarwalla, H. A. Anila,a Firoj Ali,Swaraj Rashmi Pradhan,cBishwajit Ganguly, Sumit Kumar Pramanik and Amitava Das. Chem. Commun., 2018, 54, 9079—9082.

220) Enantioselectivity of [4+2] cycloaddition between cyclopentadiene and azachalcone with DNA-based hybrid catalyst in aqueous medium: A computational study. Debashis Sahua, Kalyanashis Jana, Anik Sen and Bishwajit Ganguly. J. Indian Chem. Soc., Vol. 95, December 2018, pp. 1551-1558.

219) The effect of r/p, r and p donors on the basicity of silylene superbases: a density functional theory study. Abul Kalam Biswas,‡ Mrinal Kanti Si and Bishwajit Ganguly. New J. Chem., 2018, 42, 11153—11159.

218) Computational predictions turning the isomers of alanine to generate distinct morphs of free-flowing salt crystals. Mrinal Kanti Si, Sumit Kumar Pramanik, Vinayak Hingu and Bishwajit Ganguly. Phys. Chem. Chem. Phys., 2018, 20, 17125—17131. DOI: 10.1039/c8cp01697f

217) DFT studies on quantum mechanical tunneling in tautomerization of three-membered rings. Kalyanashis Jana ab and Bishwajit Ganguly. Phys. Chem. Chem. Phys., 2018, 20, 28049—28058.

216) Impact of ‘‘half-crown/two carbonyl’’–Ca2+ metal ion interactions of a low molecular weight gelator (LMWG) on its fiber to nanosphere morphology transformation with a gel-to-sol phase transition. Arunava Maity, Ananta Dey, Mrinal Kanti Si, Bishwajit Ganguly and Amitava Das. Soft Matter, 2018, 14, 5821—5831.

215) Rational Design of Mono- and Dianions as Superacids Through π-Hole Interaction: Implications for Lithium and Magnesium Ion Batteries Mrinal Kanti Si Bishwajit Ganguly J. Phys. Chem. C, 2018, 122 (29), pp 16464–16472 DOI: 10.1021/acs.jpcc.8b01286

214) Isatin N-protected ketimines with nitromethane catalyzed by chiral binol linked monomeric macrocyclic Cu (II)–salen complex T Menapara, R kumar Tak, S Saravanan, RI Kureshy, HK Noor-ul, . Tetrahedron 74 (49), 7000-7008. Doi.org/10.1016/j.tet.2018.10.001

213) Exploring the origin and magnitude of tetrasulfur tetranitrogen interaction with π-ring systems using first principle calculations MK Si, B Ganguly Chemical Physics Letters 713, 160-165. Doi.org/10.1016/j.cplett.2018.10.026

212) Probing the Structural and Electronic Effects on the Origin of π-Facial Stereoselectivity in 1-Methylphosphole 1-Oxide Cycloadditions and Cyclodimerization Authors Surjit Bhai, Kalyanashis Jana, Bishwajit Ganguly.ACS Omega, 2018, 3 (9), pp 10945–10952. DOI: 10.1021/acsomega.8b01165

211) DFT Study To Explore the Importance of Ring Size and Effect of Solvents on the Keto–Enol Tautomerization Process of α-and β-Cyclodiones K Jana, B Ganguly ACS Omega 3 (7), 8429-8439

210) Instant Detection of Hydrogen Cyanide Gas and Cyanide Salts in Solid Matrices and Water by using CuII and NiII Complexes of Intramolecularly Hydrogen Bonded Zwitterions RR Nair, M Raju, K Jana, D Mondal, E Suresh, B Ganguly, PB Chatterjee. CHEMISTRY-A EUROPEAN JOURNAL 24 (42), 10721-10731 Doi.org/10.1002/chem.201800894

209) Rational Design of Mono-and Dianions as Superacids Through π-Hole Interaction: Implications for Lithium and Magnesium Ion Batteries MK Si, B Ganguly The Journal of Physical Chemistry C 122 (29), 16464-16472 DOI: 10.1021/acs.jpcc.8b01286

208) Influence of gauche effect on uncharged oxime reactivators for the reactivation of tabun-inhibited AChE: quantum chemical and steered molecular dynamics studies, S Ghosh, K Jana, B Ganguly. Journal of computer-aided molecular design 32 (7), 793-807www.ncbi.nlm.nih.gov/pubmed/29980922

207) Stereoselective Metabolism of Omeprazole by Cytochrome P-450 2C19 and 3A4: Mechanistic Insights from DFT StudyKalyanashis Jana, Tusar Bandyopadhyay, Bishwajit Ganguly, J.Phys.Chem.B, DOI: 10.1021/acs.jpcb.8b01179 www.ncbi.nlm.nih.gov/pubmed/29741901

206) Transformation of Substituted Glycals to Chiral Fused Aromatic Cores via Annulative π-Extension Reactions with Arynes Nazar Hussain, Kalyanashis Jana, Bishwajit Ganguly, Debaraj Mukherjee, Organic Letters, 2018, 20, 1572-1575,


2017

205) Designed Inhibitors with Hetero Linkers for Gastric Proton Pump H+, K+-ATPase: Steered Molecular dynamics and Metadynamics studies Kalyanashis Jana, Tusar Bandyopadhyay, Bishwajit Ganguly, J. Mol. Graph. Model., 2017, 78, 129-138.

204) Nitrene insertion into an adjacent o-methoxy group followed by nucleophilic addition to the heterocumulene intermediate: Experimental and computational studies Sambasivan V Eswaran, Divneet Kaur, Kalyanashis Jana, Krishnendu Khamaru, Sripadi Prabhakar, Partha Raghunathan, Bishwajit Ganguly, Tetrahedron, 2017, 73, 5280-5288

203) α-Amino Acid Derived Benzimidazole-Linked Rhodamines: A Case of Substitution Effect at the Amino Acid Site toward Spiro Ring Opening for Selective Sensing of Al3+ Ions Anupam Majumdar, Subhendu Mondal, Constantin G Daniliuc, Debashis Sahu, Bishwajit Ganguly, Sourav Ghosh, Utpal Ghosh, Kumaresh Ghosh, Inorg. Chem., 2017, 56, 8889–8899

202) Functionalized calix [4] arene as a colorimetric dual sensor for Cu (ii) and cysteine in aqueous media: experimental and computational study M Bhatt, D Maity, V Hingu, E Suresh, Bishwajit Ganguly, P Paul, New J. Chem., 2017, 41, 12541-12553.

201) The role of non-covalent interaction for the adsorption of CO 2 and hydrocarbons with per-hydroxylated pillar [6] arene: a computational study Debashis Sahu, Kalyanashis Jana, Bishwajit Ganguly, New J. Chem., 2017, 41, 12044-120

200) Exploiting -C-F bonds of Hexafluorocyclohexane and Decafluoroadamantane Systems to Capture Flue Gases: A Computational Study Swaraj Rashmi Pradhan, Bishwajit Ganguly, ChemistrySelcet, 2017, 2, 5775–5782.

199) Revealing the Importance of Linkers in K-Series Oxime Reactivators for Tabun-Inhibited AChE Using Quantum Chemical, Docking and SMD Studies Shibaji Ghosh, Nellore Bhanu Chandar, Kalyanashis Jana, Bishwajit Ganguly, J. Comput. Aided Mol. Des. 2017, DOI: 10.1007/s10822-017-0036-3

198) Direct C–N bond formation in an in situ ligand transformation reaction and formation of polymeric 1D cadmium(II) complexes with end-to-end bridging thiocyanate or selenocyanate ions: Synthesis, structures and theoretical studies Mehul H. Sadhu, Ankita Solanki, T. Kundu, Vinayak Hingu, Bishwajit Ganguly, Sujit B. Kumar, Polyhedron, 2017, 133, 8–15.

197) The Influence of Non-Covalent Interactions in Metal–Free Organic Dye Molecules to Augment the Efficiency of Dye Sensitized Solar Cells: A Computational Study Abul Kalam Biswas, Amitava Das and Bishwajit Ganguly, Int. J. Quantum Chem. 2017, DOI: 10.1002/qua.25415

196) Effect of conformation, flexibility and intramolecular interaction on ion selectivity of calix[4]arene-based anion sensors: experimental and computational studies Debdeep Maity, Madhuri Bhatt, Mittal L. Desai, E. Suresh, Mrinal Kanti Si, Vinod P. Boricha, Bishwajit Ganguly & Parimal Paul, SupramolecularChemistry, 2017, 29, 8, 600–615

195) Exploiting hydrogen bonding interactions to probe smaller linear and cyclic diamines binding with G-quadruplexes: A DFT and Molecular Dynamics Study Mrinal Kanti Si, Anik Sen and Bishwajit Ganguly, Physical Chemistry Chemical Physics, 2017, DOI: 10.1039/C7CP00472A

194) DFT study to design Super- and Hyperacids with 1-(cyclopenta-2,4-dien-1-yl)-4-nitrobenzene and 3-(cyclopenta-2,4-dien-1-ylmethylene)-6-methylenecyclohexa-1,4-diene molecules Mrinal Kanti Si and Bishwajit Ganguly, New J. Chem., 2017, DOI: 10.1039/C6NJ03529A

193) Revealing Germylene Compounds to Attain Superbasicity with Sigma-Donor Substituents: A Density Functional Theory study Abul Kalam Biswas, Bishwajit Ganguly, Chemistry - A European Journal, DOI: 10.1002/chem.201605209


2016

192) Role of Noncovalent Interactions in Designing Inhibitors for H+,K+-ATPase: Combined QM and MD Based Investigations Kalyanashis Jana, Nellore Bhanu Chandar, Tusar Bandyopadhyay, and Bishwajit Ganguly, ChemistrySelect, 2016, 1, 6847-6854.

191) Revealing the Mechanistic Pathway of Acid Activation of Proton Pump Inhibitors to Inhibit the Gastric Proton Pump: A DFT Study Kalyanashis Jana, Tusar Bandyopadhyay, and Bishwajit Ganguly, J. Phys. Chem. B, 2016, 120, 13031-38.

190) Effective Docking Program for Designing Reactivator for Treating Organophosphorus Inhibited AChE

Shibaji Ghosh, Nellore Bhanu Chandar, Rabindranath Lo and Bishwajit Ganguly JSM Chem 2016, 4, 1032

189) A Switch-On NIR Probe for Specific Detection of Hg2+ Ion in Aqueous Medium and in Mitochondria

Hridesh Agarwalla, Pankaj S. Mahajan, Debashis Sahu, Nandaraj Taye, Bishwajit Ganguly, Santosh B. Mhaske, Samit Chattopadhyay, and Amitava Das, Inorg. Chem., 2016, 55 (22),pp 12052–12060

188) Can fused-pyrrole rings act as better π-spacer units than fusedthiophene in dye-sensitized solar cells? A computational study

Abul Kalam Biswas , Amitava Das and Bishwajit Ganguly, New J. Chem., 2016, DOI: 10.1039/C6NJ02040B

187) Visible light induced Efficient Selective Oxidation of Non-Activated Alcohols over {001} Faceted TiO2 with Molecular Oxygen

Raji Vadakkekara, Abul Kalam Biswas, Tapan Sahoo, Provas Pal, Bishwajit Ganguly, Subhash Chandra Ghosh and Asit Baran Panda, Chemistry An Asian Journal, 2016, DOI: 10.1002/asia.201601064

186) Computational evidence that hyperconjugative orbital interactions are responsible for the stability of intramolecular Te…O/Te…S non-covalent interactions and comparable to hydrogen bonds in quasi-cyclic systems

Mrinal Kanti Si, Bishwajit Ganguly, New Journal of Chemistry, 2016, DOI: 10.1039/C6NJ01707J

185) Probing the Recognition of Halide and OxyAnions in the Polarprotic and Polaraprotic Solvent Mediums with Neutral UreaBased Receptors: A Computational Study Debashis Sahu, Bishwajit Ganguly, Chemistry SELECT,

DOI: 10.1002/slct.201600568

184) Tuning the strain effect to induce selectivity through intramolecular nitrene insertion into an adjacent methoxy C H bond leading to form a new benzoxazole: experimental and computational studies. SV Eswaran, D Kaur, K Khamaru, S Prabhakar, T Sony, P Raghunathan, Bishwajit Ganguly, Tetrahedron Letters, 2016, 57, 1899-1902.

183) Does the position of the electron-donating nitrogen atom in the ring system influence the efficiency of a dye-sensitized solar cell? A computational study. Abul Kalam Biswas, Sunirmal Barik, Amitava Das & Bishwajit Ganguly, J Mol Model, 2016, 22, 1-12.

182)Chemical fixation of CO2 to cyclic carbonates using Al (III) β-aminoalcohol based efficient catalysts: An experimental and computational studies. Shailesh Verma, Mrinal Kanti Si, Rukhsana I Kureshy, Mohd Nazish, Manish Kumar, H Khan Noor-ul, Sayed HR Abdi, Hari C Bajaj and Bishwajit Ganguly, Journal of Molecular Catalysis A: Chemical, 2016, 417, 135-144

181) The reactivation of tabun-inhibited mutant AChE with Ortho-7: steered molecular dynamics and quantum chemical studies. Rabindranath Lo, Nellore Bhanu Chandar, Shibaji Ghosh and Bishwajit Ganguly, Mol. BioSyst 2016, 12, 1224-1231.

180) In Silico Studies with Substituted Adenines to Achieve Remarkable Stability of Mispairs with Thymine Nucleobase Kalyanashis Jana, Bishwajit Ganguly, New Journal of Chemistry, 2016, 1807-1816.

2015 [Top]

179) In silico design of adamantane derived organic superbases with an extended hydrogen bond network and their use as molecular containers for the storage of H2 and CO2. Krishnendu Khamaru, Bishwajit Ganguly, RSC Advances, 2015, 5, 102247-102255.

178) Can silicon substituted metal-​free organic dyes achieve better efficiency compared to silicon free organic dyes? A computational study. Abul Kalam Biswas, Amitava Das, Bishwajit Ganguly, Physical Chemistry Chemical Physics, 2015, 17, 31093-31100.

177) In silico studies on the role of mutant Y337A to reactivate tabun inhibited mAChE with K048. Nellore Bhanu Chandar, Shibaji Ghosh, Rabindranath Lo, Semire Banjo, Bishwajit Ganguly, Chemico-Biological Interactions 2015, 242, 299-306.

176) Revealing the parameters to design the habit modifiers for rock-​salt crystals: empirical to rational approach. Anik Sen, Sunirmal Barik, Ajeet Singh, Bishwajit Ganguly, Canadian Journal of Chemistry, 2015, 93, 1219-1225.

175) Specific Reagent for Cr(III)​: Imaging Cellular Uptake of Cr(III) in Hct116 Cells and Theoretical Rationalization. Firoj Ali, Sukdeb Saha, Arunava Maity, Nandaraj Taye, Mrinal Kanti Si, E. Suresh, Bishwajit Ganguly, Samit Chattopadhyay, Amitava Das, Journal of Physical Chemistry B, 2015, 119, 13018-13026.

174) Probing the selective separation of potassium ion from sodium ion with cyclopentadienyl anion as receptor: A computational study. Mittal Desai, Mrinal Kanti Si, Rabindranath Lo, Bishwajit Ganguly, Journal of Molecular Modeling, 2015, 21, 1-9.

173) In silico studies on the origin of selective uptake of carbon dioxide with cucurbit[7]​uril amorphous material. Debashis Sahu, Bishwajit Ganguly, RSC Advances, 2015, 5,89, 72469-72475.

172) The origin for highly enantioselective induction of 1-​naphthol to isatin-​derived N-​Boc ketimines catalyzed by quinine thiourea catalyst: an experimental and computational study. Prathibha kumari, Sunirmal Barik, Noorul H. Khan, Bishwajit Ganguly, Rukhsana I. Kureshy, Sayed H. R. Abdi, H. C. Bajaj, RSC Advances, 2015, 5, 85, 69493-69501.

171) Asymmetric Henry reaction of trifluoromethyl ketone and aldehyde using Cu(II)​-​complex: computational study offers the origin of enantioselectivity with varied size of catalysts. Anjan Das, Manoj K. Choudhary, Rukhsana I. Kureshy, Kalyanashis Jana, Shailesh Verma, Noor-ul H. Khan, Sayed H. R. Abdi, Hari C. Bajaj, Bishwajit Ganguly. Tetrahedron 2015, 71, 5229-5237

170) The origin and magnitude of intramolecular quasi-​cyclic S···O and S···S interactions revisited: A computational study. Mrinal Kanti Si, Rabindranath Lo, Bishwajit Ganguly. Chemical Physics Letters 2015, 631-632, 6-11

169) On the differences of separation of hazardous catechol and resorcinol through tailor-made thin film composite (TFC) membranes. P. Manna, H. Brahmbhatt, D. Sahu, Bishwajit Ganguly, A. Bhattacharya, Journal of Environmental Chemical Engineering, 2015, 3, 1758–1768.

168) Benzimidazolium-based chemosensors: selective recognition of H2PO4−, HP2O73−, F− and ATP through fluorescence and gelation studies. Kumaresh Ghosh, Debasis Kar, Debashis Sahu and Bishwajit Ganguly, RSC Adv., 2015,5, 46608-46616

167) In Silico Study on the Mechanism of Formation of Hydrazine and Nitrogen in the Reactions of Excess Hydroxylamine with 2,4-Dinitrophenyl Diethyl Phosphate. Nellore Bhanu Chandar, Bishwajit Ganguly New J.Chem. 2015, DOI:10.1039/C4NJ02300E.

166) In Silico Study on Aging and Reactivation Processes of Tabun Conjugated AChE. Nellore BhanuChandar, Rabindranath Lo, Manoj K. Kesharwani, Bishwajit Ganguly Medchemcomm 2015, DOI: 10.1039/C4MD00497C.

165) Unprecedented Iminobenzosemiquinone and Iminobenzoquinone Coordinated Mononuclear Cu (II) Complex Formation under Air. M. K. Mondal, Abul Kalam Biswas, Biswajit Ganguly and C. Mukherjee, Dalton Trans. 2015, DOI: 10.1039/c0xx00000x

164) Revealing halogen bonding interactions with anomeric systems: An ab initio quantum chemical studies. Rabindranath Lo, Bishwajit Ganguly, J. Mol. Graph. Mod. 2015, 55, 123-133.

2014 [Top]

163) Dipicrylamine as a colorimetric sensor for anions: experimental and computational study

R Gunupuru, Manoj K Kesharwani, A Chakraborty, Bishwajit Ganguly, P. Paul, RSC Advances, 2014, 4 (95), 53273-53281

162) Solar driven uphill conversion of dicyclopentadiene to cyclopentadiene: an important synthon for energy systems and fine chemicals

M. Dinda, S. Chakraborty, Mrinal Kanti Si, S. Samanta, Bishwajit Ganguly, S. Maiti, RSC Advances, 2014, 4 (97), 54558-54564

161) Quantum chemical and steered molecular dynamics studies for one pot solution to reactivate aged acetylcholinesterase with alkylator oxime

Nellore Bhanu Chandar, Rabindranath Lo, Bishwajit Ganguly Chem. Biol. Interact, 2014 DOI: 10.1016/j.cbi.2014.08.015

160) Unprecedented C-Methylation at 2-position of 2-carboxy-4-chromanone - A Case Study with Corey-Chaykovsky Reagent

SubrataGhosh, Nellore BhanuChandar, DebayanSarkar, Manoj Kumar Ghosh, Bishwajit Ganguly, Indrajit Chakraborty SynLett, 2014, DOI; 10.1055/s-0034-1379203

159) Total synthesis of novel bioactive natural product paracaseolide A and analogues: computational evaluation of a ‘proposed’ biomimetic Diels–Alder reaction

Laxmaiah Vasamsetty, Debashis Sahu, Bishwajit Ganguly, Faiz Ahmed Khan, Goverdhan Mehta Tetrahedron, 2014, DOI: 10.1016/j.tet.2014.09.072

158) In Silico Studies to Explore the Mutagenic Ability of 5-Halo/Oxy/Li-Oxy-Uracil Bases with Guanine of DNA Base-Pairs

Kalyanashis Jana, Bishwajit Ganguly J. Phys. Chem A, 2014, 118, 9753-9761.

157) Effect of amine spacer of PEG on the properties, performance and antifouling behavior of poly (piperazineamide) thin film composite nanofiltration membranes prepared by in situ PEGylation approach

Ravindra M. Gol, Anupam Bera, Semire Banjo, Bishwajit Ganguly and Suresh K. Jewrajk, J. Membrane Sci. 2014 10.1016/j.memsci.2014.08.015

156) Design of Efficient Metal–Free Organic Dyes Having Azacycl–Azine Scaffold as Donor Fragment for Dye-Sensitized Solar Cells

Abul Kalam Biswas, Sunirmal Barik, Anik Sen, Amitava Das and Bishwajit Ganguly, J. Phys. Chem. C, 2014, 118, 20763-71

155) Origin of reversal of stereoselectivity for [4+2] cycloaddition reaction between cyclopentadiene and methyl methacrylate in presence of the chloroloaluminate ionic liquid (1-Ethyl-3-methylimidazoliumchloride): in silico studies

Debashis Sahu, Manoj K. Kesharwani, Bishwajit Ganguly, Canadian J. Chem. 2014, 92, 862-67

154) Fluoride free synthesis of anatase TiO2 nanocrystals with exposed active {001} facets

Narottam Sutradhar, Abul Kalam Biswas, Sandip K. Pahari, Bishwajit Ganguly, Asit Baran Panda, Chem. Commun. 2014, 50, 11529-32

153) Asymmetric hydrolytic kinetic resolution with recyclable polymeric Co(III) - salen complexes: a practical strategy in the preparation of (S) - metoprolol, (S) - toliprolol and (S) - alprenolol: computational rationale for enantioselectivity

Tamal Roy, Sunirmal Barik, Manish Kumar, Rukhsana I. Kureshy, Bishwajit Ganguly, Noor-ul H. Khan, Sayed H. R. Abdi, Hari C. Bajaj, Catal. Sci. Technol. 2014 DOI: 10.1039/C4CY00594E

152) Can hydroxylamine be a more potent nucleophile for the reactivation of tabun-inhibited AChE than prototype oxime drugs? An answer derived from quantum chemical and steered molecular dynamics studies

Rabindranath Lo, Bishwajit Ganguly, Mol. BioSyst., 2014, 10, 2368-2383

151) Newly synthesized Ru(II) /Os(II) - polypyridyl complexes with pendent acetyleacetone functionality for coupling to nanoparticulate TiO2 surfaces and studies on interfacial electron transfer dynamics

Tanmay Banerjee, Abul Kalam Biswas, Tuhin Subhra Sahu, Bishwajit Ganguly, Amitava Das, Hirendra Nath Ghosh, Dalton Trans. 2014, 43, 13601-11

150) Superbasicity of silylene derivatives achieved via non- covalent intramolecular cation···π interactions and exploited as molecular containers for CO2. Abul Kalam Biswas, Rabindranath Lo, Mrinal Kanti Si, Bishwajit Ganguly, Phys. Chem. Chem. Phys., 2014, 16, 12567-12575.

149) Regioselectivity of Vinyl Sulfone Based 1, 3- Dipolar Cycloaddition Reactions with Sugar Azides by Computational and Experimental Studies. Debashis Sahu, Santu Dey, Tanmaya Pathak, Bishwajit Ganguly, Organic Letters (2014),16 (8), 2100–2103

148) Hydrogen Bonding Interaction between Active Methylene Hydrogen Atoms and an Anion as a Binding Motif for Anion Recognition: Experimental Studies and Theoretical Rationalization. Hridesh Agarwalla, Kalyanashis Jana, Arunava Maity, Manoj K. Kesharwani, Bishwajit Ganguly, Amitava Das, Journal of Physical Chemistry A (2014), 118(14),2656-2666.

147) Exploiting Weak Noncovalent Cation···π Interaction for Designing a Molecular Container for Storage of Methane Molecules with Lithiated Carbene Superbases. Rabindranath Lo, Bishwajit Ganguly, Journal of Physical Chemistry C (2014), 118(13),6680-6689.

146) Superior Grafting and State- of- the- Art Interfacial Electron Transfer Rates for Newly Designed Geminal Dicarboxylate Bound Ruthenium(II) - and Osmium(II) - Polypyridyl Dyes on TiO2 Nanosurface. Tanmay Banerjee, Abul Kalam Biswas, G Upendar Reddy, Tuhin Subhra Sahu, Amitava Das, Bishwajit Ganguly, Hirendra Nath Ghosh, Journalof Physical Chemistry C (2014), 118(8), 3864-3877.

2013 [Top]

145) Is the Isodesmic Reaction Approach a Better Model for Accurate Calculation of pK a of Organic Superbases? A Computational Study. Abul Kalam Biswas, Rabindranath Lo, Bishwajit Ganguly, Synlett 2013, 24(19), 2519-2524.

144) Influence of steric bulk around the vinyl sulfone bond on the reaction patterns of vinyl sulfone-modified carbohydrates. An experimental and theoretical investigation. R. Bhattacharya, M. K. Kesharwani, C. Manna, B. Ganguly, T. Pathak, J. Ind. Chem. Soc. 2013, 90, 1643-1650 (Special issue dedicated to Prof. S. Talapatra on occasion of his 80th birthday).

143) Role of Metal Ion in Specific Recognition of Pyrophosphate Ion under Physiological Conditions and Hydrolysis of the Phosphoester Linkage by Alkaline Phosphatase. Priyadip Das, Nellore Bhanu Chandar, Shishir Chourey, Hridesh Agarwalla, Bishwajit Ganguly, Amitava Das, Inorganic Chemistry (2013), 52(19), 11034-11041.

142) Probing the role of solvation in predicting the π- facial selectivity of 5- Fluoro- 2- methyleneadamantane with per- acid: A case study. Anik Sen, Bishwajit Ganguly, Computational& Theoretical Chemistry (2013), 1026, 46-54.

141) Probing the influence of solvent effect on the lithium ion binding affinity of 12- crown- O3N derivatives with unsaturated side arms: A computational study. Rajesh Patidar, Parimal Paul, Bishwajit Ganguly, Journalof Molecular Graphics & Modelling (2013), 46, 22-28.

140) Conformational preference of glycinamide in solution: An answer derived from combined experimental and computational studies. Bishwajit Ganguly, Manoj K. Kesharwani, Nikola Basaric, Eringathodi cSuresh, Abul Kalam Biswas, Kata Mlinaric-Majerski, Journalof Molecular Graphics & Modelling (2013), 46, 52-58.

139) A new receptor with a FRET based fluorescence response for selective recognition of fumaric and maleic acids in aqueous medium. G. Upendar Reddy, Rabindranath Lo, Sovan Roy, Tanmay Banerjee, Bishwajit Ganguly, Amitava Das, Chemical Communications (2013), 49(84), 9818-9820

138) In silico studies in probing the role of kinetic and structural effects of different drugs for the reactivation of tabun- inhibited AChE.Rabindranath Lo, Nellore Bhanu Chandar, Manoj K. Kesharwani, Aastha Jain, Bishwajit Ganguly, PLoS One,2013, 8, e79591-e79591

137) Bromide-bromate Couple of Varying Ratios for Bromination, Vicinal Functionalisation and Oxidation in a Clean Manner. Subbarayappa Adimurthy, Brindaban C. Ranu, Gadde Ramachandraiah, Bishwajit Ganguly and Pushpito K. Ghosh, Current Organic Synthesis, 2013, 10, 1875-6271

136) Furo[2,3-c]pyrans from a Vinyl Sulfone Modified Methyl 2,6-O-Anhydro-α-D-hexopyranoside: An Experimental and Theoretical Investigation. Chinmoy Manna, Debashis Sahu, Bishwajit Ganguly, Tanmaya Pathak, European Journal of Organic Chemistry, 2013, 2013, 8197-8207

135) Oxazoline‐Based Organocatalyst for Enantioselective Strecker Reactions: A Protocol for the Synthesis of Levamisole. Arghya Sadhukhan, Debashis Sahu, Bishwajit Ganguly, Noor-ul H. Khan, Rukhsana I. Kureshy, Sayed H. R. Abdi, E. Suresh, Hari C. Bajaj, Chemistry - A European Journal, 2013, 19, 14224

134) Molecular Interactions, Proton Exchange and Photoinduced Processes Prompted by an Inclusion Process and a [2]pseudorotaxane Formation. Amal Kumar Mandal , Moorthy Suresh , Manoj K. Kesharwani , Monalisa Gangopadhyay , Manoj Agrawal , Vinod P Boricha , Bishwajit Ganguly , Amitava Das, J. Org. Chem, DOI: 10.1021/jo400752d

133) In Silico Studies in Exploiting Weak Non-Covalent C-H+…π and π-π Interactions to Achieve the Dual Properties: Hyperbasicity and Multiple Dihydrogen Storage Materials with Paracyclophane Based Carbene Derivatives. Rabindranath Lo, Bishwajit Ganguly, J. Phys. Chem. C, 2013, DOI : 10.1021/jp406234f

132) In Silico Studies toward Understanding the Interactions of DNA Base Pairs with Protonated Linear/Cyclic Diamines. Anik Sen , Debashis Sahu, Bishwajit Ganguly, J. Phys. Chem. B, 2013, 117, 9840

131) Calix[4]arene based fluorescent chemosensor bearing coumarin as fluorogenic unit: Synthesis, characterization, ion-binding property and molecular modeling. Subrata Patra, Rabindranath Lo, Ashish Chakraborty, Ravi Gunupuru, Debdeep Maity, Bishwajit Ganguly, Parimal Paul, Polyhedron, 2013, 50, 592

130) In silico studies to probe the catalytic role of cucurbit[n]uril on [4+2] cycloaddition reaction between cyclopentadiene and methyl acrylateDebashis Sahu, Bishwajit Ganguly, Tetrahedron Letters, 2013, 54, 5246

129) Azaindole-1,2,3-triazole conjugate as selective fluorometric sensor for dihydro-genphosphate. Kumaresh Ghosh, Debasis Kar, Soumen Joardar, Debashis Sahu, Bishwajit Ganguly, RSC Advances, 2013,3, 16144-16151

128) First Principles Studies toward the Design of Silylene Superbases: A Density Functional Theory Study. Abul Kalam Biswas, Rabindranath Lo, Bishwajit Ganguly, J. Phys. Chem. A, 2013, 117, 3109

127) A first principles investigation of aging processes in soman conjugated AChE. Nellore Bhanu Chandar, Bishwajit Ganguly, Chemico-Biological Interactions, 2013, 204, 185

126) Can surface energy be a parameter to define morphological change of rock-salt crystals with additives?: A first principles study. Md Abdul Shafeeuulla Khan and Bishwajit Ganguly, CrystEngComm, 2013, 15, 2631

125) Probing the selective salt rejection behavior of thin film composite membranes: A DFT study

Rabindranath Lo, Amit Bhattacharya, Bishwajit Ganguly, Journal of Membrane Science 2013, 436, 90–96

124) In silico studies toward the recognition of fluoride ion by novel bicyclic diborane receptors and tuning through remote substituent effects. Manoj K. Kesharwani • Debashis Sahu • Ketan Desai • Bishwajit Ganguly, Theoretical Chemistry Accounts, 2013, 132 (5), 1-8

123) Synthetically amenable amide derivatives of tosylated-amino acids as organocatalysts for enantioselective allylation of aldehydes: computational rationale for enantioselectivity

Debashis Ghosh, Debashis Sahu, S. Saravanan, Sayed H. R. Abdi, Bishwajit Ganguly, Noor-ul H. Khan, Rukhsana I. Kureshy and Hari C. Bajaj, Organic & Biomolecular Chemistry, 2013, 11, 3451-3460

2012 [Top]

122) A Computational study toward understanding the separation of ions of potassium chloride microcrystal in water.

Anik Sen and Bishwajit Ganguly, Theo. Chem. Acc. 2012, 131, 1296 (1-13).

121) Cation-induced fluorescent excimer emission in calix[4]arene-chemosensors bearing quinoline as a fluorogenic unit: experimental, molecular modeling and crystallographic studies

Subrata Patra , Ravi Gunupuru , Rabindranath Lo , E. Suresh , Bishwajit Ganguly and Parimal Paul, New J. Chem., 2012,36, 988-1002

120) Is Dual Morphology of Rock-salt Crystals possible with a single additive? The answer is Barbituric acid

Anik Sen, Bishwajit Ganguly, Angew. Chem. Int. Ed., 2012, 51, 11279-11283.

119) Origins of reversing diastereoselectivity of α,β-dichloro-γ-butenolides and γ-butyrolactams in direct vinylogous aldol addition: a computational studyMd Abdul Shafeeuulla Khan , Ji Zhang , Koushik Das Sarma and Bishwajit Ganguly, RSC Adv., 2012,2, 8460-8466.

118) Rational Design on a new class of polycyclic organic bases bearing two superbasic sites and their applications in CO2 capture and activation processRabindranath Lo, Ajeet Singh, Manoj K. Kesharwani and Bishwajit Ganguly, Chem. Commun. 2012, 48, 5865.

117) Energetics of Ortho-7 (Oxime Drug) Translocation through the Active-Site Gorge of Tabun Conjugated Acetylcholinesterase Vivek Sinha, Bishwajit Ganguly, Tusar Bandyopadhyay, PLoS ONE, 2012, 7, e40188. (DOI:10.1371/journal.pone.0040188).

116) New Chemodosimetric Reagents as Ratiometric Probes for Cysteine and Homocysteine and Possible Detection in Living Cells and in Blood PlasmaP. Das, A. K. Mandal, N. B. Chandar, M. Baidya, H. B. Bhatt, B. Ganguly, S. K. Ghosh and A. Das, Chem. Eur. J. 2012, 18, 15382-15393

115) Efficacy of carbenes for CO2 chemical fixation and activation by their superbasicity/alcohol: A DFT study Rabindranath Lo, Bishwajit Ganguly, New J. Chem. 2012,36, 2549-2554

114) Generation and Trapping of a Cage Annulated Vinylidenecarbene and Approaches to Its Cycloalkyne Isomer

B. Sahu, G. N. Gururaja, T. Kumar, A. Chatterjee, B. Ganguly, S. M. Mobin, I. N. N. Namboothiri, J. Org. Chem., 2012, 77, 6998.

113) In silico studies towards the recognition of fluoride ion by substituted borazinesManoj K. Kesharwani, Bishwajit Ganguly, J. Mol. Graph. Modell. 2012 (DOI: 10.1016/j.jmgm.2012.06.005).

112) Microwave assisted isomerization of alkenyl aromatics over solid base catalysts: An understanding through theoretical study C. M. Jinesh, Anik Sen, Bishwajit Ganguly and S. Kannan, Rsc. Adv. 2012, 2, 6871-6878.

111) Photosensitization of nanoparticulate TiO2 using a Re(I)-polypyridyl complex: studies on interfacial electron transfer in the ultrafast time domain Prasenjit Kar, Tanmay Banerjee, Sandeep Verma, Anik Sen, Amitava Das, Bishwajit Ganguly and Hirendra N. Ghosh, Phys. Chem. Chem. Phys. 2012, 14, 8192-8198.

110) Probing O-Dealkyalation and Deamination Aging Processes in Tabun Conjugated AChE: A Computational Study

Manoj K. Kesharwani, Tusar Bandyopadhyay and Bishwajit Ganguly, Theor. Chem. Acc.2012 (Accepted)

109) An alternative approach: A highly selective dual responding fluoride sensor having active methylene group as binding site Priyadip Das, Manoj K. Kesharwani, Amal K. Mandal, E. Suresh, Bishwajit Ganguly and Amitava Das, Org. Biomol. Chem. 2012 (DOI: 10.1039/c2ob06815).

108) Probing the simulant behavior of PNPDPP towards parathion and paraoxon: A computational study Md A. S. Khan, T. Bandyopadhyay and B. Ganguly, J. Mol. Graph. Modell. 2012, 34, 10-17.

107) Ratiometric Detection of Cr3+ and Hg2+ by a Naphthalimide-Rhodamine based Fluorescent Probe

Prasenjit Mahato, Sukdeb Saha, E. Suresh, Rosa Di Liddo, Pier Paolo Parnigotto, Maria Teresa Conconi, Manoj K. Kesharwani, Bishwajit Ganguly and Amitava Das, Inorg. Chem. 2012, 51, 1769-1777.

106) Probing the O...Br–Br halogen bonding in X-ray crystal structures with ab initio calculations Rabindranath Lo, Amar Ballabh, Ajeet Singh, Parthasarathi Dastidar and Bishwajit Ganguly Cryst. Eng. Comm., 2012, 14, 1833-1841.

105) Does Bridging Geometry Influence Interfacial Electron Transfer Dynamics? Case of the Enediol-TiO2 System Sreejith Kaniyankandy, Sachin Rawalekar, Anik Sen, Bishwajit Ganguly, and Hirendra N. Ghosh, J. Phys. Chem. C 2012, 116, 98-103.

104) Assessing the reactivation efficacy of hydroxylamine anion towards VX-inhibited AChE: a computational study

Md Abdul Shafeeuulla Khan and Bishwajit Ganguly, J. Mol. Model 2012, 18, 1801-1808.

2011 [Top]

103) Exploiting Propane-1,3-diimines as Building Blocks for Superbases: A DFT Study Rabindranath Lo and Bishwajit Ganguly, New. J. Chem. 2011, 35, 2544-2550.

102) A computational approach towards predicting π-facial selectivity in sterically unbiased olefins: an evaluation of the relative importance of electrostatic and orbital effects A. Sen, Goverdhan Mehta and B. Ganguly, Tetrahedron 2011, 67, 3754-3762.

101) Structural studies of PCU-hydrazones: NMR spectroscopy, X-ray diffractions, and DFT calculations

Jelena Veljkovic, Marina Šekutor, Krešimir Molcanov, Rabindranath Lo, Bishwajit Ganguly, Kata Mlinaric-Majerski, J. Mol. Struct. 2011, 997, 46-52.

100) First principle studies toward the design of a new class of carbine superbases involving intramolecular H….π interactions Rabindranath Lo and Bishwajit Ganguly, Chem. Commun. 2011, 47, 7395-7397.

99) Can Nitrilotriacetic Acid (NTA) Act as a Habit Modifier for Rock Salt Crystals? An Answer from Computational and Experimental Studies Md Abdul Shafeeuulla Khan, Ajeet Singh, Soumya Haldar, and Bishwajit Ganguly Cryst. Growth Des. 2011, 11, 1675–1682.(Published as part of a virtual special issue on Structural Chemistry in India: Emerging Themes)

98) Probing the reactivation process of sarin-inhibited acetylcholinesterase with a-nucleophiles: Hydroxylamine anion is predicted to be a better antidote with DFT calculations M. A. S. Khan, R. Lo, T. Bandyopadhyay and B. Ganguly, J. Mol. Graph. Modell. 2011, 29, 1039–1046.

97) Receptor Design and Extraction of Fluoride Ion Present as NaF in Aqueous Medium: Rationalization by DFT Studies Priyadip Das, Amal K. Mandal, Manoj K. Kesharwani, E. Suresh, Bishwajit Ganguly and Amitava Das, Chem. Commun. 2011, 47, 7398-7400.

96) Borazine as a sensor for Fluoride Ion: A Computational and Experimental Study Manoj K. Kesharwani, Moorthy Suresh, Amitava Das and Bishwajit Ganguly, Tetrahedron Letters 2011, 52, 3636-3639.

95) Zn(II)-2-2’:6,2’’-terpyridine Based Complex as Fluorescent Chemosensor for PPi, AMP and ADP Priyadip Das, Amrita Ghosh, Manoj K. Kesharwani, Vadde Ramu, Bishwajit Ganguly, and Amitava Das, Eur. J. Inorg. Chem. 2011, 3050-3058.

94) Probing the Structural and Electronic Effects to Stabilize Non-planar forms of Thioamide Derivatives: A Computational Study Manoj K. Kesharwani, and Bishwajit Ganguly, J. Comput. Chem. 2011, 32, 2170-2176.

93) Imidazolium ions to control the folding motion in a Naphthalene-Coumarin based crown ether: Studies on inclusion and resonance energy transfer processes in [2]pseudorotaxane M. Suresh, A. K. Mandal, M. K. Kesharwani, B. Ganguly, R. KumarKanaparthi, A. Samanta and A. Das, J. Org. Chem. 2011, 76, 138-144.

92) Hydrolysis and retro-aldol cleavage of Ethyl threo-2-(1-adamantyl)-3-hydroxybutyrate: Competing reactions

B. Ganguly, M. K. Kesharwani, M. Matković, N. Basarić, A. Singh and K. Mlinarić-Majerski, J. Phys. Org. Chem. 2011, 24, 578-587.

2010 [Top]

91) Probing the influence of solvent effects on the conformational behavior of 1,4-diazacyclohexane systems A. Sen, A. Singh and B. Ganguly, J. Mol. Struct. 2010, 984, 294-299.

90) Probing the Influence of Anomeric Effects on the Lithium Ion Affinity in 1,3-Diaza Systems: A Computational Study M. K. Kesharwani, W. Thiel and B. Ganguly, J. Phys. Chem. A 2010, 114, 10684-10693.

89) Effect of steric crowding on ion selectivity for calix-crown hybrid ionophores: Experimental, molecular modeling and crystallographic studies S. Patra, D. Maity, A. Sen, E. Suresh, B. Ganguly and P. Paul, New. J. Chem. 2010, 34, 2796-2805.

88) Probing the influence of electronic effects of organic additives on the morphology of sodium chloride crystals: A combined experimental and computational study A. Singh, M. Suresh, and B. Ganguly, Crys. Eng. Comm. 2010, 12, 4168-4175.

87) What is the minimum number of water molecules required to dissolve a potassium chloride molecule? A. Sen and B. Ganguly, J. Comput. Chem.2010, 31, 2948-2954.

86) A density functional study towards substituent effects on anion sensing with urea receptors A. Ghosh, D. A. Jose, A. Das and B. Ganguly, J. Mol. Model. 2010, 16, 1441-1448.

85) Sensitization of nanocrystalline TiO2 anchored with pendant catechol functionality using a new tetracyanato Ruthenium(II) polypyridyl complex P. Kar, S. Verma, A. Sen, A. Das, B. Ganguly, and H. N. Ghosh, Inorg. Chem. 2010, 49, 4167–4174.

84) Electrostatic origin towards the reversal of π-facial selectivity of 5,6-cis,exo-disubstituted bicyclic[2.2.2]oct-2-enes with m-chloroperbenzoic acid and diazomethane: A computational study A. Sen and B. Ganguly, Tetrahedron Letters 2010, 51, 143-146.

83) Making full use of the oxidizing equivalents in bromate in the selective oxidation of thiols, sulfides, and benzylic/secondary alcohols into disulfides, sulfoxides, and aldehydes/ketones G. Joshi, S. Bhadra, S. Ghosh, M. K. Agrawal, B. Ganguly, S. Adimurthy, P. K. Ghosh, and B. C. Ranu, Ind. Eng. Chem. Res. 2010, 49, 1236–1241.

82) First principle study towards the influence of Cd2+ on the morphology of sodium chloride A. Singh, A. Sen and B. Ganguly, J. Mol. Graph. Model 2010, 28, 413-419.

81) An experimental and theoretical study on the remarkable influence of protecting groups on the selectivity of addition of amines to vinyl sulfone-modified hex-2-enopyranosides R. Bhattacharya, M. K. Kesharwani, C. Manna, B. Ganguly, C. G. Suresh and T. Pathak, ­J. Org. Chem. 2010, 75, 303-314.

80) Remarkable effect of hydroxylamine anion towards the solvolysis of sarin: A DFT study Md A. S. Khan, M. K. Kesharwani, T. Bandyopadhyay and B. Ganguly, J. Mol. Struct. (THEOCHEM) 2010, 944, 132–136.

79) Differential binding of bispyridinium oxime drugs with acetylcholinesterase M. K. Kesharwani, B. Ganguly, A. Das and T. Bandyopadhyay, Acta Pharmacologica Sinica 2010, 31, 313–328.

78) Solvolysis process of organophosphorus compound P-[2-(dimethylamino)ethyl]-N,N-dimethylphosphonamidic fluoride with Simple and a-nucleophiles: A DFT study M. K. Kesharwani, Md A. S. Khan, T. Bandyopadhyay and B. Ganguly, Theor. Chem. Acc. 2010, 127, 39-47.

77) Anion recognition through hydrogen bonding by adamantane-dipyrromethane receptors M. Alešković, N. Basarić, K. Mlinarić-Majerski, K. Molčanov, B. Kojić-Prodić, M. K. Kesharwani and B. Ganguly, Tetrahedron 2010, 66, 1689–1698.

2009 [Top]

76) Probing the influence of pH dependent citric acid towards the morphology of rock salt: A computational study

Md A. S. Khan, A. Sen and B. Ganguly, Cryst. Eng. Comm. 2009, 11, 2660-2667.

75) Solvolysis of chemical warfare agent VX is more efficient with hydroxylamine anion: A computational study

Md A. S. Khan, M. K. Kesharwani, T. Bandyopadhyay and B. Ganguly, J. Mol. Graph. Model. 2009, 28, 177-182.

74) Influence of urea N–H acidity on receptor–anionic and neutral analyte binding in a Ruthenium(II)–polypyridyl-based colorimetric sensor A. Ghosh, S. Verma, B. Ganguly, H. N. Ghosh, and A. Das, Eur. J. Inorg. Chem. 2009, 2496-2507.

73) Solvent effects on the stereoselectivity of reaction of methyl acrylate, methyl methacrylate and methyl trans-crotonate with cyclopentadiene: A computational study M. K. Kesharwani and B. Ganguly, Croat. Chim. Acta 2009, 82, 291-298. (invited article)

72) DFT studies on a new class of cage functionalized organic superbases A. Singh and B. Ganguly, New J. Chem. 2009, 33, 583-587.

71) Comparative study of the vicinal functionalisation of olefins with 2:1 bromide/bromate and iodide/iodate reagents M. K. Agrawal, S. Adimurthy, B. Ganguly and P. K. Ghosh, Tetrahedron 2009, 65, 2791-2797.

70) Morphology of potassium chloride in aqueous and in formamide solution - An experimental and computational investigation A. Singh, T. Selvamani, I. Mukopadhyay and B. Ganguly, Can. J. Chem. 2009, 87, 514-522.

69) Influence of formamide on the crystal habit of LiF, NaCl, and KI: A DFT and aqueous solvent model study A. Singh, M. K. Kesharwani and B. Ganguly, Cryst. Growth Des. 2009, 9, 77-81.

2008 [Top]

68) Synthetic and theoretical investigations on the construction of oxanorbornenes by a michael addition and intramolecular Diels-Alder furan reaction

M. Dadwal, M. K. Kesharwani, V. Danayak, B. Ganguly, S. M. Mobin, R. Muruganantham and I. N. N. Namboothiri, Eur. J. Org. Chem. 2008, 6106-6118.

67) Studies on the separation performances of chlorophenol compounds from water by thin film composite membranes Yogesh, K.M. Popat, B. Ganguly, H. Brahmbhatt and A. Bhattacharya, Macromol. Res. 2008, 16, 590-595.

66) Pentachlorophenol removal from water using surfactant-enhanced filtration through low-pressure thin film composite membrane Y. Kumar, K.M. Popat, H. Brahmbhatt, B. Ganguly and A. Bhattacharya, J. Hazard. Mater. 2008, 154, 426-431.

65) DFT study of urea interaction with potassium chloride surfaces A. Singh and B. Ganguly, Mol. Simulation 2008, 34, 973-979.

64) Strategic design of small and versatile bicyclic organic superbases: A density functional study A. Singh and B. Ganguly, New J. Chem. 2008, 32, 210–213.

63) Conformational analysis of 2-(1-adamantyl)-3-hydroxybutyric acid by 1H NMR spectroscopy and computational studies B. Ganguly, A. Singh, N. Basarić, M. Matković, and K. M. Majerski, J. Mol. Struct. 2008, 888, 238-243.

62) Studies of performances by the interchanging of the sequence of the photomodified layer in the thin film composite (TFC) membrane Yogesh, S. Gupta, S. Javiya, P. Paul, S. Basu, K. Singh, B. Ganguly and A. Bhattacharya, J. Appl. Polym. Sci., 2008, 108, 2611-2616.

61) X-ray crystallographic investigations of an azacryptand and its Bis-protonated salt: Interactions of acyclic water trimer and C-H…π Interactions in T-shaped benzene dimer P. S. Lakshminarayanan, D. K. Kumar, I. Ravikumar, B. Ganguly, and P. Ghosh, Synthesis and Reactivity in Inorganic, Metal-Organic, and Nano-Metal Chemistry, 2008, 38, 2–11,

2007 [Top]

60) Probing the influence of solvent effects on the conformational behavior of 1,3-Diazacyclohexane systems A. Singh and B. Ganguly, J. Phys. Chem. A 2007, 111, 9884-9889.

59) Rational design and first-principles studies toward the remote substituent effects on a novel tetracyclic proton sponge A. Singh and B. Ganguly, J. Phys. Chem. A 2007, 111, 6468-6471.

58) A computational study of urea and its homologue glycinamide; Conformations, rotational barriers, and relative interactions with sodium chloride A. Singh, S. Chakraborty and B. Ganguly Langmuir, 2007, 23, 5406-5411.

57) Phenol and catechol-based Ruthenium(II)-polypyridyl complexes as colorimetric sensors for fluoride ions D. A. Jose, P. Kar, D. Koley, B. Ganguly, W. Thiel, H. N. Ghosh and A. Das, Inorg. Chem. 2007, 46, 5576-5584.

56) Rugby-ball-shaped sulfate–water–sulfate adduct encapsulated in a neutral molecular receptor capsule D. A. Jose, D. K. Kumar, B. Ganguly, and A. Das, Inorg. Chem. 2007, 46, 5817-5819.

55) Urea-based Ruthenium(II)-Polypyridyl complex as an optical sensor for anions: Synthesis, characterization, and binding studies A. Ghosh, B. Ganguly, and A. Das, Inorg. Chem. 2007, 46, 9912-9918.

54) Intra-annular cyclophane diamines as proton sponges: A computational study B. Ganguly, D. Koley and W. Thiel, Tetrahedron 2007, 63, 7970-7976.

53) Role of positional isomers on receptor–anion binding and evidence for resonance energy transfer D. A. Jose, D. K. Kumar, P. Kar, S. Verma, A. Ghosh , B. Ganguly, H. N. Ghosh and A. Das, Tetrahedron 2007, 63, 12007-12014.

52) DFT studies toward the design and discovery of a versatile cage functionalized proton sponge A. Singh and B. Ganguly, Eur. J. Org. Chem. 2007, 420-422.

51) Preferential binding of the magnesium ion by anthraquinone based chromogenic receptors P. Kar, M. Suresh, D. K. Kumar, D. A. Jose, B. Ganguly and A. Das, Polyhedron 2007, 26, 1317-1322.

50) A density functional study towards the preferential binding of anions to urea and thiourea D. A. Jose, A. Singh, A. Das and B. Ganguly, Tetrahedron Lett. 2007, 48, 3695-3698.

49) An experimental and computational analysis on the differential role of the positional isomers of symmetric bis-2- (pyridyl)-1H-benzimidazoles as DNA binding agents P. Chaudhuri, B. Ganguly and S. Bhattacharya, J. Org. Chem. 2007, 72, 1912-1923.

48) Conformational analysis and the binding sites of nitrilotriacetamide: A computational study A. Singh, S. Chakraborty and B. Ganguly, Int. J. Quantum Chem. 2007, 107, 1430-1436.

2006 [Top]

47) Performance study of thin film composite polyamide membranes in remediation of nitro-phenols from water

K. Yogesh, K. M. Popat, H. R. Brahmbhatt, B. Ganguly and A. Bhattacharya, J. Appl. Membrane Science & Technology, 2006, 4, 23-30.

46) C2-chiral substituted cis-1,3,5,7-tetraazadecalin as proton sponges: A computational study A. Singh, S. Chakraborty and B. Ganguly, Eur. J. Org. Chem. 2006, 4938-4942.

2005 [Top]

45) Urea and thiourea based efficient colorimetric sensors for oxyanions D. A. Jose, D. K. Kumar, B. Ganguly and A. Das, Tetrahedron Lett. 2005, 46, 5343-5346.

44) Towards understanding of the selective precipitation of alkali metal cations in presence of dipicrylamine anion

Suresh E, P. Agnihotri, B. Ganguly, P. Bhatt, P. S. Subramanian, P. Paul and P. K. Ghosh, Eur. J. Inorg. Chem., 2005, 2198-2205.

43) Study of the competitive binding of mixed alkali and alkaline earth metal ions with dibenzo-30- Crown-10

P. Agnihotri, Suresh E., B. Ganguly, P. Paul and P. K. Ghosh, Polyhedron, 2005, 24, 1023-1032.

42) Synthesis, characterization, physicochemical and photophysical studies of some redox switchable NIR dye derived from a ruthenium-dioxolene-porphyrin system D. A. Jose, A. D. Shukla, D. K. kumar, B. Ganguly, A. Das, G. Ramakrishna, D. K. Palit and H. N., Ghosh, Inorg. Chem. 2005, 44, 2414-2425.

41) Efficient and simple colorimetric fluoride ion sensor based on receptors having urea and thiourea binding sites

D. A. Jose, D. K. Kumar, B. Ganguly and A. Das, ISRAPS Bulletin. 2005, 5.


2004 [Top]

40) Computational study on hydroxybenzotriazoles as reagents for ester hydrolysis V. P. Kumar, B. Ganguly and S. Bhattacharya, J. Org. Chem. 2004, 69, 8634-8642.

39) Efficient and simple colorimetric fluoride ion sensor based on receptors having urea and thiourea binding sites D. A. Jose, D. K. Kumar, B. Ganguly and A. Das, Org. Lett. 2004, 6, 3445-3448.

38) Structure-property correlation of a new family of organogelators based on organic salts and their selective gelation of oil from oil/water mixture D. R. Trivedi, A. Ballabh, P. Dastidar and B. Ganguly, Chem. Eur. J. 2004, 10, 5311-5322.

37) A semi-empirical and density functional study on the origin of regioselective epoxy ring opening of 2',3’-lyxoanhydrothymidine B. Ganguly, J. Mol. Struct. (THEOCHEM), 2004, 673, 127-132.

36) Selectivities in the 1,3-dipolar cycloaddition of nitrile oxides to dicyclopentadiene and its derivatives

I. N.N. Namboothiri, N. Rastogi, B. Ganguly, S. M. Mobin and M. Cojocaru, Tetrahedron 2004, 60, 1453-1462.

2003 [Top]

35) Selective extraction of alkali metal ions from bittern using picrate anion and crown ethers as ligand: An experimental and theoretical study P. Agnihotri, B. Ganguly, E. suresh, P. Paul and P. K. Ghosh, Ind. J. Chem. A 2003, 42, 2439.

34) Experimental and theoretical studies of Diels-Alder dimerization of 1,2,3,4,5-Pentachlorocyclopentadiene and of Diels-Alder cycloaddition of polychlorinated cyclopentadienes to norbornadiene

A. P. Marchand, B. Ganguly, C. I. Malagón, H. Lai and W. H. Watson, Tetrahedron 2003, 59, 1763-1771.


2002 [Top]

33) Redox switchable NIR dye derived from Ruthenium-dioxolene-porphyrin systems A. D. Shukla, B. Ganguly, P. C. Dave, A. Samanta and A. Das, Chem. Commun. 2002, 2648-2649.

32) Stereoselective and regioselective synthesis of azepane and azepine derivatives via piperidine ring expansion

H-S. Chong, B. Ganguly, G. A. Broker, R. D. Rogers and M. W. Brechbiel, J. Chem. Soc. Perkin Trans 1 2002, 2080-2086.

31) Tandem cyclization-cycloaddition behaviour of Rhodium carbenoids with carbonyl compounds: Stereoselective studies on the construction of novel epoxy-bridged tetrahydropyranone frameworks S. Muthusamy, S. A. Babu, C. Gunanathan, B. Ganguly, E. Suresh and P. Dastidar, J. Org. Chem. 2002, 67, 8019-8033.

2001 [Top]

30) p-Facial Selectivities and proximal/distal regioselectivities in Diels-Alder reactions of unsymmetrical, cage-annulated 1,3-cyclhexadienes A. P. Marchand, H-S chong, B. Ganguly, R. Shukla, E-Z Dong, A. Hazelwood, T. D. Power, W. H. Watson and S. G. Bott, Tetrahedron, 2001, 57, 8629-8635.

29) Probing the influence of stereoelectronic effects on lithium affinity in 1,3- and 1,4-dioxa systems B. Ganguly and B. Fuchs, J. Phys. Org. Chem. 2001, 14, 488-494.

28) Synthesis of novel chiral, cage-annulated macrocycle A. P. Marchand, M. Takhi, V. S. Kumar, K. Kasireddy and B. Ganguly, ARKIVOC 2001, (iii) 13-21.

27) Stereoelectronic control of additions of Vinylmagnesium bromide to 1-Methyl- and 3-Methylpentacyclo[5.4.0.02,6-03,10.05,9]undecane-8,11-diones and to 1-Methylhexacyclo [10.2.1.02,11.04,9.04,14.09,13]-pentadeca-5,7-diene-3,10-dione A. P. Marchand, J. M. Keith, S. Alihodžic, B. Ganguly, A. W. Somers, H. K. Hariprakasha, T. D. Power, W. H. Watson and S. G. Bodige, Struct. Chem. 2001, 12, 313-322.

26) Relevance of torsional effects to the conformational equilibria of 1,5-diaza-cis-decalins: A theoretical and experimental study B. Ganguly, D. A. Freed and M. C. Kozlowski, J. Org. Chem. 2001, 66, 1103-1108.

2000 [Top]

25) π-facial selectivity in Diels-Alder cycloadditions A. P. Marchand, H-S Chong, B. Ganguly and J. M. Coxon, Croatia Chimica Acta, 2000, 73, 1027-1038.

24) On relative importance of O–H/π interactions in 7-Norbornenols A. P. Marchand and B. Ganguly, Struct. Chem. 2000, 11, 241-244.

23) Stereoelectronic effects in negatively and positively (protonated) charged species. Ab initio studies of the gauche effect in 1,4 dioxa systems B. Ganguly and B. Fuchs, J. Org. Chem. 2000, 65, 558-561.

1999 [Top]

22) Synthesis of a novel cage-functionalized chiral binaphthol host: A potential new agent for enantiomeric cecognition of chiral ammonium salt A. P. Marchand, H-S Chong and B. Ganguly, Tetrahedron Asymmetry 1999, 10, 4695-4700.

21) Experimental and theoretical investigations into the stereoselectivities of peracid promoted epoxidations of substituted norbornenes and norbornadienes A. P. Marchand, B. Ganguly, R. Shukla, K. Krishnudu, V. Satish Kumar, W. H. Watson and S. G. Bodige, Tetrahedron 1999, 55, 8313-8322.

20) Generation and trapping of an unsymmetrical caged pyramidalized alkene A. P. Marchand, I. N. N Namboothiri, B. Ganguly, W. H. Watson and S. G. Bodige, Tetrahedron Lett. 1999, 40, 5105-5109.

19) On the origins of diastereofacialselectivity in Diels-Alder cycloadditions J. M. Coxon, R. D. J. Froese, B. Ganguly, A. P. Marchand and K. Morokuma, Syn Lett. (Account) 1999, 11, 1681-1703.

18) Theoretical study of the molecular structure and spectroscopic properties of 1,7;3,5-dimethylene-cis-1,3,5,7-tetraazadecalin V. Galasso, O. Reany, B. Ganguly, S. Abrahamson, B. Fuchs and D. Jones, J. Mol. Struct. (THEOCHEM) 1999, 491, 187-191.


1998 [Top]

17) Photochemical chlorocarbonylation of HCTD by oxalyl chloride. carbocation mediated rearrangement of HCTD derivatives to novel, substituted heptacyclopentadecane A. P. Marchand, S, Alihodzic, I. N. N. Namboothiri and B. Ganguly, J. Org. Chem. 1998, 63, 8390-8396.

16) The 1,3,5,7-Tetraazadecalins: Structure, conformation and stereoelectronics: Theory vs experiment O. Reany, I. Goldberg, S. Abramson, L. Golender, B. Ganguly and B. Fuchs, J. Org. Chem. 1998, 63, 8850-8859.

15) Thermodynamic rearrangement of pentacyclo [5.4.0.02.6.03.10.05.9] undecane Skeleton K. Mlinaric-Majerski, J. Velkovic, B. Ganguly and A. P. Marchand. Tetrahedron 1998, 54, 11381-11386.

14) Thermodynamic vs. kinetic control in the Diels-Alder cycloaddition of cyclopentadiene to 2,3-dicyano-p-benzoquinone: Kinetic control revisited A. P. Marchand, B. Ganguly, W. H. Watson and S. G. Bodige, Tetrahedron 1998, 54, 10967-10972.

13) Study of vinylidenecarbene-cycloalkyne equilibrium in the D3- trishomocubyl ring system A. P. Marchand, I. N. N. Namboothiri, B. Ganguly and S. G. Bott, J. Am. Chem. Soc. 1998, 120, 6871-6876.

12) trans- vs cis-1,3,5,7-tetraoxadecalin: A structural, thermochemical, and computational study A. Linden, H.-D. Beckhaus, S. P. Verevkin, C. Ruchardt, B. Ganguly and B. Fuchs, J. Org. Chem. 1998, 63, 8205-8211.

11) Stereoselectivity of Diels-Alder cycloadditions of π-facially nonequivalent dienes to MTAD, PTAD and N-Methylmaleimide: A theoretical study A. P. Marchand, B. Ganguly and R. Shukla, Tetrahedron 1998, 4477-4484.

1997 [Top]

10) 4-susbstituted norsnoutanones: a new probe system for evaluating electronic effects in π-facial selectivity in nucleophilic additions G. Mehta, C. Ravikrishna, B. Ganguly and J. Chandrasekhar, J. Chem. Soc., Chem. Commun. 1997, 75-76.

9) Stereoelectronic effects in negatively and positively (protonated) charged dioxa species. An ab initio study of anomeric effect in 1,3-dioxa systems B. Ganguly and B. Fuchs, J. Org. Chem. 1997, 62, 8892-8901.


1995 [Top]

8) Conformational preferences of α-functionalised keten-S,N acetals: Potential role of S..O and S..S interactions in solution A. N. Dixit, K. V Reddy, A. R. A. S. Deshmukh, S. Rajappa, B. Ganguly and J. Chandrasekhar, Tetrahedron 1995, 51, 1437-1448.


1994 [Top]

7) Electron states of benzene…HCl and toluene…HCl hydrogen bonded complexes by ultraviolet photoelectron spectroscopy S. P. Ananthavel, B. Ganguly, J. Chandrasekhar, M. S. Hegde and C. N. R. Rao, Chem. Phy. Lett. 1994, 217, 101-104.

6) Electrophilic additions to 7-Methylenenorbornanes and 7-Isopropylidene-norbornanes: Can remote substituents swamp electrostatic control of π-face selectivity G. Mehta, G. Guansekharan, S. R. Gadre, R. N. Shirsat, B. Ganguly and J. Chandrasekhar, J. Org. Chem. 1994, 59, 1953-1955.

5) Electrostatic vs orbital control to facial selectivities in π-system: Experimental and theoretical study of electrophilic additions to 7-isopropylidenenorbornene G. Mehta, F. A. Khan, S. R. Gadre, R. N. Shirsat, B. Ganguly and J. Chandrasekhar, Angew. Chem. Int. Ed. Engl. 1994, 33, 1390-1393.

4) π-Facial diastereoselection in reduction of sterically unbiased ketones containing the norbornyl framework: Further tests for theoretical models G. Mehta, F. A. Khan, B. Ganguly and J. Chandrasekhar, J. Chem. Soc. Perkin Trans II 1994, 2275-2277.


1993 [Top]

3) A simple computational model for predicting π-facial selectivity in reductions of sterically unbiased ketones: On the relative importance of electrostatic and orbital interactions B. Ganguly, J. Chandrasekhar, F. A. Khan and G. Mehta, J. Org. Chem. 1993, 58, 1734-1739.


1992 [Top]

2) Importance of orbital and electrostatic interactions in determining π- facial selectivity in nucleophilic additions to endo-susbtituted bicyclo [2,2,2]octane-2-ones G. Mehta, F. A. Khan, B. Ganguly and J. Chandrasekhar, J. Chem. Soc., Chem. Commun, 1992, 1711-1712.

1) Ground state geometric distortions vs distal substituent effect in determining the π-facial selectivity in 7-norbornenonesV. A. Kumar, K. Venkatesan, B. Ganguly, J. Chandrasekhar, F. A. Khan and G. Mehta, Tetrahedron Lett. 1992, 33, 3069-3072.