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	1.	Qualitative as well as quantitative analysis of interactions present in chlorine and bromine substituted aromatic organic crystals: A DFT linked Crystal Explorer study. [electronic resource] by Khera, Mayank Goel, Neetu Producer: 20210531 In: Journal of molecular graphics & modelling vol. 95 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Menshutkin reaction between DABCO and benzyfluoride/fluorodiphenylmethane: a mechanistic study. [electronic resource] by Singh, Amritpal Goel, Neetu Producer: 20151019 In: Journal of molecular modeling vol. 20 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Single-Atom Catalysis Using Chromium Embedded in Divacant Graphene for Conversion of Dinitrogen to Ammonia. [electronic resource] by Riyaz, Mohd Goel, Neetu Publication details: Chemphyschem : a European journal of chemical physics and physical chemistry Aug 2019 In: Chemphyschem : a European journal of chemical physics and physical chemistry vol. 20 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Understanding structure-activity relation in V [electronic resource] by Kaur, Navjot Gupta, Shuchi Goel, Neetu Producer: 20191010 In: Journal of molecular modeling vol. 25 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	Structural evolution and stability of hydrogenated Li(n) (n = 1-30) clusters: a density functional study. [electronic resource] by Gautam, Seema Dharamvir, Keya Goel, Neetu Producer: 20110929 In: The journal of physical chemistry. A vol. 115 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	Correction: Enantioselective synthesis of sulfoxide using an SBA-15 supported vanadia catalyst: a computational elucidation using a QM/MM approach. [electronic resource] by Kaur, Navjot Gupta, Shuchi Goel, Neetu Publication details: Physical chemistry chemical physics : PCCP 01 2018 In: Physical chemistry chemical physics : PCCP vol. 20 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	Enantioselective synthesis of sulfoxide using an SBA-15 supported vanadia catalyst: a computational elucidation using a QM/MM approach. [electronic resource] by Kaur, Navjot Gupta, Shuchi Goel, Neetu Producer: 20180205 In: Physical chemistry chemical physics : PCCP vol. 19 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	Dispersion corrected density functional study of CO oxidation on pristine/functionalized/doped graphene surfaces in aqueous phase. [electronic resource] by Riyaz, Mohd Yadav, Sarita Goel, Neetu Producer: 20190918 In: Journal of molecular graphics & modelling vol. 79 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	Nucleotide conjugated (ZnO) [electronic resource] by Kumari, Indu Kaur, Navjot Gupta, Shuchi Goel, Neetu Producer: 20200214 In: Journal of molecular graphics & modelling vol. 87 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	Theoretical study of adsorption of amino acids on graphene and BN sheet in gas and aqueous phase with empirical DFT dispersion correction. [electronic resource] by Singla, Preeti Riyaz, Mohd Singhal, Sonal Goel, Neetu Producer: 20161107 In: Physical chemistry chemical physics : PCCP vol. 18 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	A QM/MM study on ethene and benzene oxidation using silica-supported chromium trioxide. [electronic resource] by Kumari, Indu Kaur, Navjot Gupta, Shuchi Goel, Neetu Producer: 20190108 In: Journal of molecular modeling vol. 25 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	Spin Inversion Phenomenon and Two-State Reactivity Mechanism for Direct Benzene Hydroxylation by V [electronic resource] by Kaur, Navjot Kumari, Indu Gupta, Shuchi Goel, Neetu Producer: 20180123 In: The journal of physical chemistry. A vol. 120 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	Mechanistic details of amino acid catalyzed two-component Mannich reaction: experimental study backed by density functional calculations. [electronic resource] by Rani, Dixita Thakur, Lalita Khera, Mayank Goel, Neetu Agarwal, Jyoti Producer: 20200504 In: Amino acids vol. 51 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	Removal of fluoroquinolone from aqueous solution using graphene oxide: experimental and computational elucidation. [electronic resource] by Yadav, Sarita Goel, Neetu Kumar, Vinod Tikoo, Kulbhushan Singhal, Sonal Producer: 20181107 In: Environmental science and pollution research international vol. 25 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	Correction to: Removal of fluoroquinolone from aqueous solution using graphene oxide: experimental and computational elucidation. [electronic resource] by Yadav, Sarita Goel, Neetu Kumar, Vinod Tikoo, Kulbhushan Singhal, Sonal Publication details: Environmental science and pollution research international 06 2018 In: Environmental science and pollution research international vol. 25 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Functionalized magnetic nanomaterials for rapid and effective adsorptive removal of fluoroquinolones: Comprehensive experimental cum computational investigations. [electronic resource] by Malik, Rupal Goyal, Ankita Yadav, Sarita Gupta, Nancy Goel, Neetu Kaushik, Anupama Kumar, Vinod Tikoo, K B Singhal, Sonal Producer: 20200528 In: Journal of hazardous materials vol. 364 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)