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Collection's Items (Sorted by Submit Date in Descending order): 1021 to 1040 of 1065
Issue DateTitleAuthor(s)
1999-04-22On non-negativity of Fukui function indicesRoy, Ram Kinkar
2000-12Basicity of the framework oxygen atom of alkali and alkaline earth-exchanged zeolites: a hard–soft acid–base approachRoy, Ram Kinkar
2001A Simple Model to Predict Preferable Aldol Products from Unsymmetrical Ketones Using Local Hard−Soft Acid−Base ConceptRoy, Ram Kinkar
2001A Simple Model to Predict Preferable Aldol Products from Unsymmetrical Ketones Using Local Hard−Soft Acid−Base ConceptRoy, Ram Kinkar
2001-08-06Mulliken population analysis based evaluation of condensed Fukui function indices using fractional molecular chargeRoy, Ram Kinkar
1999-06-15Reactivity and stability of aromatic carbonyl compounds using density functional theory-based local and global reactivity descriptorsRoy, Ram Kinkar
2002-05-06Variational principles for describing chemical reactions: Condensed reactivity indicesRoy, Ram Kinkar
2002Chiral Interaction in Enantiomeric and Racemic Dipalmitoyl Phosphatidylcholine Langmuir MonolayerRoy, Ram Kinkar
2002-12-28Nucleophilic Substitution Reaction of Alkyl Halides:  A Case Study on Density Functional Theory (DFT) Based Local Reactivity DescriptorsRoy, Ram Kinkar
2003-11-11Stockholders Charge Partitioning Technique. A Reliable Electron Population Analysis Scheme to Predict Intramolecular Reactivity SequenceRoy, Ram Kinkar
2004-05Local reactivity descriptors to predict the strength of Lewis acid sites in alkali cation-exchanged zeolitesRoy, Ram Kinkar
2004On the Reliability of Global and Local Electrophilicity DescriptorsRoy, Ram Kinkar
2005Are the Local Electrophilicity Descriptors Reliable Indicators of Global Electrophilicity Trends?Roy, Ram Kinkar
2006-03-08Acetalization and thioacetalization of cabonyl compounds: A case study based on global and local electrophilicity descriptorsRoy, Ram Kinkar
2006Chemoselectivities in Acetalization, Thioacetalization, Oxathioacetalization and AzathioacetalizationRoy, Ram Kinkar
2017-07-21“One-into-Many” Model:  An Approach on DFT Based Reactivity Descriptor to Predict the Regioselectivity of Large SystemsRoy, Ram Kinkar
2008N-Dependence problem of local hardness parameterRoy, Ram Kinkar
2008-11-25Are the Hirshfeld and Mulliken population analysis schemes consistent with chemical intuition?Roy, Ram Kinkar
2009-06-19Ionic liquid catalyzed expeditious synthesis of 2-aryl-2,3-dihydroquinolin-4(1H)-ones and 2-aryl-2,3-dihydro-4H-chromen-4-ones under microwave irradiationRoy, Ram Kinkar
2009A comprehensive decomposition analysis of stabilization energy (CDASE) and its application in locating the rate-determining step of multi-step reactionsRoy, Ram Kinkar
Collection's Items (Sorted by Submit Date in Descending order): 1021 to 1040 of 1065