Skip to main content

9 Result(s)

within Apurba K. Bhattacharjee Remove this filter

and

  1. No Access

    Article

    A review on recent theoretical approaches made in the discovery of potential Covid-19 therapeutics

    SARS CoV-2 virus (COVID-19) emerged as a highly infectious human pathogen in late 2019. Started in China but rapidly started spreading all over the world and soon became a pandemic. More than seven million dea...

    Apurba K Bhattacharjee in Journal of Mathematical Chemistry (2024)

  2. No Access

    Article

    In silico evaluation of 6-(2,6-dichlorophenyl)-pyrido[2,3-d]pyrimidin-7(8H)-one compounds: an insight into design of less toxic anticancer drugs

    The study presents both three-dimensional quantitative structure–activity relationship (3D-QSAR) and quantitative/qualitative structure–toxicity relationship (QSTR) analyses for the 6-(2,6-dichlorophenyl)-pyri...

    Manish C. Bagchi, Sisir Nandi, Apurba K. Bhattacharjee in Medicinal Chemistry Research (2016)

  3. No Access

    Article

    Novel semi-automated methodology for develo** highly predictive QSAR models: application for development of QSAR models for insect repellent amides

    Conventional 3D-QSAR models are built using global minimum conformations or quantum-mechanics based geometry-optimized conformations as bioactive conformers. QSAR models developed using the global minima as bi...

    Jayendra B. Bhonsle, Apurba K. Bhattacharjee, Raj K. Gupta in Journal of Molecular Modeling (2007)

  4. Chapter and Conference Paper

    In Silico Three Dimensional Pharmacophore Models to Aid the Discovery and Design of New Antimalarial Agents

    Malaria is one of the most dangerous diseases affecting primarily poor people of tropical and subtropical regions. The search for novel drugs against specific parasites is an important goal for antimalarial dr...

    Apurba K. Bhattacharjee, Mark G. Hartell… in Computational Science – ICCS 2006 (2006)

    Download PDF (376 KB)

  5. No Access

    Article

    Crystal structure of the potent bisquinoline antimalarial agent (±)-trans-N 1,N 2-bis(7-chloroquinolin-4-yl) cyclohexane-1,2-diamine dimethanesulfonate salt hydrate in relation to its biological properties

    The neighboring 4-aminoquinoline substituents of the bisquinoline (±)-trans-N 1,N 2-bis(7-chloroquinolin-4-yl)cyclohexane-1,2-diamine dimethanesulfonate salt crystallized in the diequatorial position which is in ...

    Jean M. Karle, Apurba K. Bhattacharjee… in Journal of Chemical Crystallography (2002)

  6. No Access

    Chapter

    Vaccines Against Bacterial Endotoxins

    The use of vaccines that induce antibodies to either highly conserved epitopes in the LPS core or to serotype-specific antigens (O-polysaccharide or CPS) remains a viable strategy for the prevention and/or tre...

    Apurba K. Bhattacharjee, Alan S. Cross, Steven M. Opal in The Sepsis Text (2002)

  7. No Access

    Article

    Role of Molecular Electronic Properties of Some Novel Antimalarial Cyclic Peroxy Ketals in Relation to Potency and Potential Toxicity

    Calculated molecular electronicproperties of 20 recently reported cyclic peroxy ketals have been rationalized with their in vitro antimalarial activity with the overall goal to guide the design for safer and effe...

    Apurba K. Bhattacharjee, Jean M. Karle in Molecular Engineering (1999)

  8. Article

    Immunoprophylaxis Against Bacterial Sepsis

    Sepsis can be viewed as toxigenic illness resulting from the release of excess quantities of microbial-derived inflammatory mediators into the systemic circulation. Principal among these microbial mediators is...

    Steven M. Opal, Alan S. Cross, Apurba K. Bhattacharjee, Kumar Visvanathan… in Sepsis (1999)

    Download PDF (186 KB)

  9. No Access

    Article

    Trifluoromethyl group disorder in crystalline 2,8-bis(trifluoromethyl)-4-hydroxymethylquinoline

    The title compound crystallized in space groupPna21 with lattice constantsa=13.406(1),b=18.799 (4), andc=4.785(1). The molecule is essentially flat with only fluorine atoms, methylene hydrogen atoms, and the hydr...

    Jean M. Karle, Apurba K. Bhattacharjee in Journal of Chemical Crystallography (1996)