Relevant bibliographies by topics / Novel Molecules

Academic literature on the topic 'Novel Molecules'

Author: Grafiati
Published: 10 December 2022
Last updated: 28 January 2023

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Journal articles on the topic "Novel Molecules"

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Yu, Chang Feng. "A Novel High Precision Analytic Potential Function for Diatomic Molecules." Key Engineering Materials 645-646 (May 2015): 313–18. http://dx.doi.org/10.4028/www.scientific.net/kem.645-646.313.

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A new analytical potential energy functions is presented, the potential energy function is examined by 13 examples of different diatomic molecules or ions——homonuclear ground-state for neutral diatomic molecules, heternuclear ground-state for charged diatomic molecular ion, heternuclear excitation-state neutral diatomic molecules ,heternuclear excited-state for charged diatomic molecular ion, homonuclear excited-state for neutral diatomic molecule , homonuclear excited-state for charged diatomic moleculeetc.. as a consequence, the theoretical values of the vibrational energy level of molecules calculated by the potential energy function are in high-precision consistent with RKR data (Rydberg-Klein-Rees) or experimental data.
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Walker, Michael A. "Novel antiviral molecules." Drug Discovery Today 7, no. 20 (October 2002): 1065–66. http://dx.doi.org/10.1016/s1359-6446(02)02471-6.

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Westwell, Andrew D. "Novel antitumour molecules." Drug Discovery Today 8, no. 1 (January 2003): 47–50. http://dx.doi.org/10.1016/s1359-6446(02)02551-5.

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Westwell, Andrew D. "Novel antitumour molecules." Drug Discovery Today 8, no. 5 (March 2003): 229–31. http://dx.doi.org/10.1016/s1359-6446(03)02622-9.

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Westwell, A. "Novel antitumour molecules." Drug Discovery Today 8, no. 9 (May 1, 2003): 421–22. http://dx.doi.org/10.1016/s1359-6446(03)02676-x.

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Westwell, Andrew D. "Novel antitumour molecules." Drug Discovery Today 8, no. 15 (August 2003): 718–19. http://dx.doi.org/10.1016/s1359-6446(03)02776-4.

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Westwell, Andrew D. "Novel antitumour molecules." Drug Discovery Today 8, no. 20 (October 2003): 955–57. http://dx.doi.org/10.1016/s1359-6446(03)02834-4.

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Westwell, Andrew. "Novel antitumour molecules." Drug Discovery Today 6, no. 4 (February 2001): 215–16. http://dx.doi.org/10.1016/s1359-6446(00)01619-6.

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Westwell, Andrew. "Novel antitumour molecules." Drug Discovery Today 6, no. 9 (May 2001): 489–91. http://dx.doi.org/10.1016/s1359-6446(01)01755-x.

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Westwell, Andrew. "Novel antitumour molecules." Drug Discovery Today 6, no. 12 (June 2001): 648–49. http://dx.doi.org/10.1016/s1359-6446(01)01829-3.

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Dissertations / Theses on the topic "Novel Molecules"

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Walsh, Anthony. "Novel methods to access bioactive molecules." Thesis, University of Huddersfield, 2015. http://eprints.hud.ac.uk/id/eprint/26947/.

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This thesis is divided into two chapters detailing research on applying microwave methodology to access aminated nucleosides in significantly reduced time frames, and applying the Belluš-Claisen reaction to produce non-proteogenic dipeptides. 1. Amination of Nucleosides Using Microwave Methodology 2,2’-Anhydrouridine undergoes a ring opening reaction with aliphatic amines to give the corresponding aminated product. Under conventional heating reaction times are extremely lengthy, taking at least 3 to 4 days and up to a month in the case of very hindered amines. A modified procedure using microwave irradiation has proven to drastically reduce reaction time and has allowed access to novel nucleosides on gram scale. 2. Functionalised Amino Acids via the Belluš-Claisen Rearrangement The Belluš-Claisen reaction is a [3,3] sigmatropic rearrangement of allylic amines, ethers and thioethers to give the corresponding amide, ester of thioester. A modified procedure of the Belluš-Claisen rearrangement was used to prepare functionalised dipeptides by reaction of a ketene prepared from N-phthaloylglycyl chloride in situ with allylic amino acid derivatives in the presence of a Lewis Acid and diisopropylethylamine. Rearrangments were successfully carried out using N,N-diallyl alanine and N-allyl proline. A range of N-allyl proline derivatives are demonstrated. However, attempts to repeat the reaction with structurally more complex amino acids did not result in successful reactions.
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Odenthal, Katherine Jane Chemistry Faculty of Science UNSW. "Novel redox molecules for surface electrochemistry." Publisher:University of New South Wales. Chemistry, 2009. http://handle.unsw.edu.au/1959.4/43661.

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The research presented herein reports the development of two novel redox molecules for biosensing applications. Frequently electrochemical biosensors necessitate the use of strictly controlled conditions including the pH of the surrounding solution. Electrochemical biosensors that only operate under such conditions are not viable as portable sensors for in-field analysis. Consequently, a method for measuring the pH in conjunction with electrochemical biosensors would provide an opening for such sensors in in-field analysis. A novel redox molecule, JUGSH, has been prepared for this purpose. In a separate investigation, a ruthenium complex has been prepared which allows tuning of its formal potential by altering the structure of one ligand. This novel redox molecule is destined for use in multi-analyte arrays. By altering the formal potential of the redox molecule, a series of redox reporters can be prepared to allow differentiation between analytes. The novel redox molecule JUGSH consists of a hydroxy-naphthoquinone with an alkanethiol chain that allows formation of a self-assembled monolayer (SAM) of JUGSH on gold electrodes. X-ray spectroscopy analysis was employed for characterisation. The electrochemical properties of a JUGSH SAM were investigated along with the pH dependence of the formal potential. After further research into the pH dependence of the electron transfer rate coefficient, JUGSH was applied to the analysis of pH together with an electrochemical biosensor. Two peptide sensors for metal detection developed previously were employed to test the concept of measuring pH with JUGSH. The peptides employed were angiotensin I and Gly-Gly-His immobilised on a thioctic acid SAM and 3-mercaptopropionic acid SAM for lead and copper detection respectively. JUGSH was demonstrated to have the ability to measure the pH of the analyte solution allowing compensation of the sensor??s electrochemical response. The angiotensin I sensor was shown to have a viable working range from pH 3 to pH 7. A ruthenium complex containing two bipyridine ligands and a diketone ligand has been prepared that shows a shift in the formal potential upon alteration of the diketone ligand. Modification of the complex to include methylamine groups was attempted but non-ideal electrochemistry was indicated and no shift in the formal potential was observed after modifying the diketone ligand. Further work is required before attachment of the complex to a surface can be investigated.
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Strelko, Cheryl. "Novel Small Molecules and Tumor Cells." Thesis, Boston College, 2012. http://hdl.handle.net/2345/3778.

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Thesis advisor: Mary F. Roberts
Thesis advisor: Eranthie Weerapana
Small molecules are of interest both as metabolites in tumor cell biology and as potential therapeutics in the fight against cancer. In this work, small molecules in both roles have been examined. Modulation of tumor cell metabolism holds promise as a strategy to combat cancer, and both glucose and glutamine have been identified as critical fuels for tumor cell growth and proliferation. However, the reason for glutamine addiction is poorly understood. The differential metabolism of glutamine and glucose was therefore examined using ¹³C labeling and NMR-based metabolomics in the VM-M3 tumor cell line, which requires both glucose and glutamine for survival and proliferation. In the course of this study, a novel mammalian metabolite itaconic acid was identified. Itaconic acid was detected in extracts and tissue culture media from the murine macrophage-derived tumor cell lines VM-M3 and RAW 264.7 as well as in primary macrophages. Production and secretion of itaconic acid was increased upon stimulation. LC-MS and NMR based metabolomics studies show that this metabolite is synthesized by the decarboxylation of cis-aconitate from the TCA cycle, and provided evidence for a novel mammalian homologue of the enzyme cis-aconitic decarboxylase. D-3-deoxy diC₈PI is a small molecule of interest as a potential cancer therapeutic. This compound was designed to induce apoptosis in tumor cells by competitively binding to the Akt PH domain and preventing Akt translocation. However, high resolution ³¹P field-cycling studies show that both D-3-deoxy diC₈PI and an inactive analogue L-3,5-dideoxy diC₈PI bind to the same site on the PH domain, which is distinct from the binding site of the ligand diC₈PI(3,4,5)P₃. This makes the aforementioned mechanism of cytotoxicity unlikely. Aggregation of the PH domain in the presence of soluble headgroup IP₆ was also observed, which may be related to a physiological function of this protein and invalidates at least one other binding assay. Investigation into alterations in signaling pathways in the MCF-7 breast cancer cell line showed that D-3-deoxy diC₈PI activates the p38MAPK pathway which results in CREB hyperphosphorylation. However, activation of this pathway appears to be compensatory and unrelated to the mechanism of action. D-3-deoxy diC₈PI also decreases levels of cyclin D1 and cyclin D3, which regulate the progression of the cell cycle. These decreases appear to be occurring at the transcriptional level rather than due to increased proteasomal degradation. The loss of these two proteins does not cause apoptosis in MCF-7 cells, but siRNA knockdown of specifically cyclin D1 inhibits proliferation. This is consistent with the cell cycle arrest observed upon D-3-deoxy diC₈PI treatment in these cells. These findings do not conclusively elucidate the mechanism of cytotoxicity of D-3-deoxy diC₈PI, but provide a characterization of some of its effects in the MCF-7 cell line which may be useful for further studies
Thesis (PhD) — Boston College, 2012
Submitted to: Boston College. Graduate School of Arts and Sciences
Discipline: Chemistry
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Adamson, R. D. "Novel methods for large molecules in quantum chemistry." Thesis, University of Cambridge, 1999. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.595361.

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With the rapid increase in computing power Quantum Chemists are looking towards larger and larger molecules. This thesis presents new ways to reduce the expensive scaling of computational cost with system size, thus allowing the advances in computer science to be utilized. The first chapter is an introduction to Hartree-Fock theory and the traditional methods of calculating electron correlation. This is followed by an introduction to Density Functional Theory, concentrating on Kohn-Sham density functional theory. Chapter 3 presents a new way of assessing the accuracy of a density functional by partitioning the density and examining the energy of the component pieces. Chapter 4 describes a new density functional (EDF1), designed especially for small basis sets, thus making it ideal for large systems. The functional is formed from several other common functionals, grouped together in a way to minimize the error of the chemical energetics of a selection of molecules. Chapter 5 gives an introduction to modern two-electron integral theory and then describes a new method for efficiently calculating integrals arising from charges that are well separated. The new algorithm does not scale with the concentration of the basis set. The efficient algorithm of Chapter 5 is O(N2) overall, and therefore still too slow. To truly examine large molecules O(N) methods are required. Chapter 6 provides an introduction to these linear methods and also presents a new method, the CASE approximation, which neglects long-range interactions. How to implement this new method (in O(N) work) is described in Chapter 7. The method is extended to density functional theory in Chapter 8 by attenuating the Dirac functional. Chapter 9 presents a second way to reduce the magnitude (and speed) of the approximation, and also a correction for the main failure of the original approximation. Chapter 10 examines the accuracy of the approximation on a variety of chemical properties. The final chapter describes a way to improve the accuracy of CASE by correcting for the neglected terms in only O(N) work. This correction however is not without its own problems and work continues in this area.
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Smith, Euan Christopher. "Ultrafast third-order nonlinearities in novel zwitterionic molecules." Thesis, Heriot-Watt University, 1998. http://hdl.handle.net/10399/599.

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Drayna, Garrett Korda. "Novel Applications of Buffer-Gas Cooling to Cold Atoms, Diatomic Molecules, and Large Molecules." Thesis, Harvard University, 2016. http://nrs.harvard.edu/urn-3:HUL.InstRepos:26718757.

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Cold gases of atoms and molecules provide a system for the exploration of a diverse set of physical phenomena. For example, cold gasses of magnetically and electrically polar atoms and molecules are ideal systems for quantum simulation and quantum computation experiments, and cold gasses of large polar molecules allow for novel spectroscopic techniques. Buffer-gas cooling is a robust and widely applicable method for cooling atoms and molecules to temperatures of approximately 1 Kelvin. In this thesis, I present novel applications of buffer-gas cooling to obtaining gases of trapped, ultracold atoms and diatomic molecules, as well as the study of the cooling of large organic molecules. In the first experiment of this thesis, a buffer-gas beam source of atoms is used to directly load a magneto-optical trap. Due to the versatility of the buffer-gas beam source, we obtain trapped, sub-milliKelvin gases of four different lanthanide species using the same experimental apparatus. In the second experiment of this thesis, a buffer-gas beam is used as the initial stage of an experiment to directly laser cool and magneto-optically trap the diatomic molecule CaF. In the third experiment of this thesis, buffer-gas cooling is used to study the cooling of the conformational state of large organic molecules. We directly observe conformational relaxation of gas-phase 1,2-propanediol due to cold collisions with helium gas. Lastly, I present preliminary results on a variety of novel applications of buffer-gas cooling, such as mixture analysis, separation of chiral mixtures, the measurement of parity-violation in chiral molecules, and the cooling and spectroscopy of highly unstable reaction intermediates.
Chemical Physics
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Tetteh, Kevin Kwaku Adjei. "Molecular characterisation of novel functionally important molecules of the model parasitic nematode, Toxocara canis." Thesis, University of Edinburgh, 1999. http://hdl.handle.net/1842/11455.

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The gastrointestinal parasite of dogs and their related species, Toxocara canis, is a prime example of a zoonotic parasite. It is the principal agent of visceral larva migrans and also a cause of ocular larval migrans. As a result of the close association that dogs have with man, the parasite enjoys a world-wide distribution. Infections can be contracted from contaminated soil and handling of infected dogs, and is particularly prevalent amongst professions that have a close association with dogs, such as hydatid control officers in New Zealand. Once inside the non-canid host, the parasite enters a state of arrested development, in which it neither grows nor differentiates. In this state the parasite releases up to 1% of its body weight in excretory/secretory antigens per day. Assuming that this high protein production was in some way linked to immune evasion, a modest EST project was undertaken using a cDNA library generated from infective larvae. The hypothesis behind this approach was that the high protein output demonstrated by these parasites would be mirrored at the mRNA level. In total 266 clones were sequenced, the majority of which were from the both the 5' and 3' ends of the transcripts. Homologues for these genes were sought by similarity searching against the GenBank protein and the dbEST nucleotide databases. Cluster analysis of the clones identified 129 distinct gene products, all but three of which represented new genes. The majority of the genes (96) were represented by single clones, although 8 transcripts were present at high frequencies, each composing >2% of all the clones sequenced. These high abundance transcripts include a mucin and a novel C-type lectin, which together comprise the two major excretory/secretory antigens released by the parasite. Four highly expressed novel transcripts were found, termed ant genes (abundant novel transcripts). Together these genes represented 18% of all the cDNA clones isolated, but no similar sequences occur in the C. elegans genome. While the coding regions of these genes are dissimilar, they exhibit a remarkable level of similarity in their 3' UTR at the nucleotide level. The discovery of these abundant parasite specific genes, of newly-identified lectins and mucins, as well as a range of conserved and novel proteins, provide defined candidates for future analysis of the molecular basis of immune evasion by Toxocara.
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Neri, Tommaso. "Novel organic semiconducting small molecules for X-ray detection." Master's thesis, Alma Mater Studiorum - Università di Bologna, 2017. http://amslaurea.unibo.it/14809/.

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L’elettronica organica ha trovato negli anni recenti diverse applicazioni, anche in dispositivi di uso quotidiano, come ad esempio gli schermi OLED (Organic Light Emitting Diode). I semiconduttori organici possono essere depositati con tecniche a basso costo, anche su scala industriale, e su grandi aree, fattore, quest’ultimo, che li rende particolarmente adatti alla fabbricazione di sensori di radiazioni ionizzanti. Il lavoro presentato riguarda la realizzazione di transistor organici a film sottile e la loro caratterizzazione, come transistor e come sensori di raggi X. In particolare, l’obiettivo di questo progetto sperimentale è il confronto delle sensibilità di due tipi di dispositivi fabbricati da soluzioni delle molecole diF-TES-ADT (5,11-bis(triethylsilylethynyl)anthradithiophene) e diF-TEG-ADT (5,11-bis(triethylgermylethynyl)anthradithiophene), appartenenti alla classe degli eteroaceni sostituiti. Nella prima molecola sono presenti due gruppi funzionali identici in cui è contenuto un atomo di silicio, mentre nell'altra essi contengono un atomo di germanio, caratterizzato da un numero atomico più alto. In questo lavoro viene dimostrato che il numero atomico più alto, grazie al maggiore coefficiente di assorbimento per la radiazione X, comporta una sensibilità più alta per il sensore di razioni ionizzanti, come confermato dai risultati ottenuti.
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Shen, Dong. "Syntheses and mesophase characterizations of novel bent core molecules." [S.l. : s.n.], 2000. http://deposit.ddb.de/cgi-bin/dokserv?idn=961481889.

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Dattani, Hema. "Novel Tripodal Receptors Designed to Recognize Anionic Guest Molecules." Thesis, University of Oxford, 2008. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.489428.

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The aim of this thesis is to develop novel tripodal receptors for the recognition of anionic guest species. Interaction between host and guest is analyzed by a variety of spectroscopic methods including ¹H NMR, UV-Visible, luminescence and electrochemical techniques.
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Books on the topic "Novel Molecules"

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Modeling marvels: Computational anticipation of novel molecules. [Dordrecht]: Springer, 2008.

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Banik, Bimal K., ed. β-Lactams: Unique Structures of Distinction for Novel Molecules. Berlin, Heidelberg: Springer Berlin Heidelberg, 2013. http://dx.doi.org/10.1007/978-3-642-33188-6.

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Ali, Sami Mohammed. Relaxation studies of various molecules using a novel modulated temperature technique. Salford: Universityof Salford, 1985.

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Molecular modeling for the design of novel performance chemicals and materials. Boca Raton: CRC Press, 2012.

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M, Blow D., Fersht Alan 1943-, Winter G, and Royal Society (Great Britain), eds. Design, construction, and properties of novel protein molecules: Proceedings of a Royal Society discussion meeting, held on 5 and 6 June 1985. London: Royal Society, 1986.

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Astrid, Gräslund, Rigler Rudolf, and Widengren Jerker, eds. Single molecule spectroscopy in chemistry, physics and biology: Nobel Symposium. Heidelburg [Germany]: Springer, 2010.

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Rudolf, Rigler, Orrit M. 1956-, and Basché T, eds. Single molecule spectroscopy: Nobel conference lectures. Berlin: Springer, 2001.

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Benfenati, Fabio, Enzo Di Fabrizio, and Vincent Torre, eds. Novel Approaches for Single Molecule Activation and Detection. Berlin, Heidelberg: Springer Berlin Heidelberg, 2014. http://dx.doi.org/10.1007/978-3-662-43367-6.

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Pruzanski, Waldemar, and Peter Vadas, eds. Novel Molecular Approaches to Anti-Inflammatory Therapy. Basel: Birkhäuser Basel, 1995. http://dx.doi.org/10.1007/978-3-0348-7276-8.

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Treacher, Kevin Edward. Molecular and polymeric assemblies of novel substituted phthalocyanines. Manchester: University of Manchester, 1995.

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Book chapters on the topic "Novel Molecules"

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Vukelic, Valeria Lourdes, and Marcelo Orias. "Novel Molecules." In Chronic Kidney Disease and Hypertension, 47–55. New York, NY: Springer New York, 2014. http://dx.doi.org/10.1007/978-1-4939-1982-6_5.

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Horstkorte, Rüdiger, Bettina Büttner, Kaya Bork, Navdeep Sahota, Sarah Sabir, Laura O’Regan, Joelle Blot, et al. "NSP, Novel Serine Protease." In Encyclopedia of Signaling Molecules, 1274. New York, NY: Springer New York, 2012. http://dx.doi.org/10.1007/978-1-4419-0461-4_100942.

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Kalia, Vipin Chandra. "Mining Metagenomes for Novel Bioactive Molecules." In Mining of Microbial Wealth and MetaGenomics, 1–9. Singapore: Springer Singapore, 2017. http://dx.doi.org/10.1007/978-981-10-5708-3_1.

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Singhal, Paavan, Anita Rani Gill, Preeti K. Sharma, Rakesh Kumar, Nabin Bhusal, Amandeep Kaur, and Pooja Sharma. "Aptamers: Novel Therapeutic and Diagnostic Molecules." In Aptamers, 73–89. Singapore: Springer Singapore, 2019. http://dx.doi.org/10.1007/978-981-13-8836-1_5.

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Fassina, Giorgio. "Complementary Peptides as Recognition Molecules." In Novel Molecular Approaches to Anti-Inflammatory Therapy, 109–20. Basel: Birkhäuser Basel, 1995. http://dx.doi.org/10.1007/978-3-0348-7276-8_11.

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Ignat’ev, Nikolai, Sergii Datsenko, and Elena Smertenko. "Electrochemical Introduction of Fluorinated Substituents into Organic Molecules." In Novel Trends in Electroorganic Synthesis, 305–8. Tokyo: Springer Japan, 1998. http://dx.doi.org/10.1007/978-4-431-65924-2_92.

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Hochuli, E. "Genetically Designed Affinity Chromatography Using a Novel Metal Chelate Absorbent." In Biologically Active Molecules, 217–39. Berlin, Heidelberg: Springer Berlin Heidelberg, 1989. http://dx.doi.org/10.1007/978-3-642-74582-9_10.

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Deshmukh, Sunil K., Manish K. Gupta, Ved Prakash, and M. Sudhakara Reddy. "Fungal Endophytes -a Novel Source of Cytotoxic Compounds." In Bioactive Molecules in Food, 1–62. Cham: Springer International Publishing, 2018. http://dx.doi.org/10.1007/978-3-319-76900-4_13-1.

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Kumar, Vinod, Shalini Rai, Pallavi Gaur, and Tayaba Fatima. "Endophytic Fungi: Novel Sources of Anticancer Molecules." In Advances in Endophytic Research, 389–422. New Delhi: Springer India, 2013. http://dx.doi.org/10.1007/978-81-322-1575-2_20.

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MacCalman, C. D., A. Omigbodun, X. C. Tian, J. E. Fortune, E. E. Furth, C. Coutifaris, and J. F. Strauss. "Novel Cell Adhesion Molecules: Roles in Implantation?" In The Endometrium as a Target for Contraception, 137–57. Berlin, Heidelberg: Springer Berlin Heidelberg, 1997. http://dx.doi.org/10.1007/978-3-662-10323-4_7.

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Conference papers on the topic "Novel Molecules"

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Abney, Josh, and Matthew Dietrich. "LASER ABLATION MOLECULAR SPECTROSCOPY OF NOVEL BARIUM MOLECULES." In 2020 International Symposium on Molecular Spectroscopy. Urbana, Illinois: University of Illinois at Urbana-Champaign, 2020. http://dx.doi.org/10.15278/isms.2020.rk09.

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Lee, Hongki, Kyungnam Kang, Kentaro Mochizuki, Changhun Lee, Hajun Yoo, Woo Joong Rhee, Gwiyeong Moon, et al. "Plasmon-enhanced Raman microscopy of cell membrane molecules." In Novel Techniques in Microscopy. Washington, D.C.: OSA, 2021. http://dx.doi.org/10.1364/ntm.2021.nm3c.2.

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Lin, Linhan, Xiaolei Peng, and Yuebing Zheng. "Manipulating Fano coupling in all-dielectric meta-molecules." In Novel Optical Materials and Applications. Washington, D.C.: OSA, 2019. http://dx.doi.org/10.1364/noma.2019.now1b.4.

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de Valk, Kim S., and Alexander L. Vahrmeijer. "The clinical translation of novel near-infrared fluorophores for fluorescence guided surgery." In Molecular-Guided Surgery: Molecules, Devices, and Applications V, edited by Brian W. Pogue and Sylvain Gioux. SPIE, 2019. http://dx.doi.org/10.1117/12.2516413.

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Henderson, Eric R., Alisha V. DSouza, Keith D. Paulsen, and Brian W. Pogue. "Novel applications of near-infrared fluorescence imaging in orthopaedic surgery (Conference Presentation)." In Molecular-Guided Surgery: Molecules, Devices, and Applications III, edited by Brian W. Pogue and Sylvain Gioux. SPIE, 2017. http://dx.doi.org/10.1117/12.2257091.

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Arrondo, C. "In-situ coalescence of aligned C60 molecules in Peapods." In ELECTRONIC PROPERTIES OF NOVEL NANOSTRUCTURES: XIX International Winterschool/Euroconference on Electronic Properties of Novel Materials. AIP, 2005. http://dx.doi.org/10.1063/1.2103881.

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Barth, Connor W., and Summer L. Gibbs. "The advantages and disadvantages of novel contrast agent types for fluorescence guided surgery." In Molecular-Guided Surgery: Molecules, Devices, and Applications VIII, edited by Summer L. Gibbs, Brian W. Pogue, and Sylvain Gioux. SPIE, 2022. http://dx.doi.org/10.1117/12.2613182.

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Fink, H. W. "Electrical conduction through DNA molecules." In The 14th international winterschool on electronic properties of novel materials - molecular nanostructures. AIP, 2000. http://dx.doi.org/10.1063/1.1342554.

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Farnam, Richard. "IS-001: investigating a novel compound for fluorescent ureteral identification during robotic hysterectomy (Conference Presentation)." In Molecular-Guided Surgery: Molecules, Devices, and Applications IV, edited by Greg Biggs, Brian W. Pogue, and Sylvain Gioux. SPIE, 2018. http://dx.doi.org/10.1117/12.2291974.

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Xie, Jian-Fei, and Bing-Yang Cao. "Molecular Dynamics Study on Fluid Flow in Nanochannels With Permeable Walls." In ASME 2016 5th International Conference on Micro/Nanoscale Heat and Mass Transfer. American Society of Mechanical Engineers, 2016. http://dx.doi.org/10.1115/mnhmt2016-6421.

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This paper presents the fluid flow in nanochannels with permeable walls using the molecular dynamics (MD) simulations. A three-dimensional Couette flow has been carried out to investigate the effect of the permeable surface on the fluid density distributions and the slip velocity. The ordering layer of molecules is constructed near the smooth surface but it was destroyed by the permeable ones resulting in the density drop in porous wall. The fluid density in porous wall is large under strong fluid-structure interaction (FSI) and it is decreased under weak FSI. The negative slip is observed for fluid flow past solid walls under strong FSI, no-slip under medium FSI and positive slip under weak FSI whatever it is smooth or porous. Moreover, the largest slip velocity and slip length occur on the smooth surface of solid wall. As predicted by Maxwell theory, the molecule is bounced back when it impinges on the smooth surface. The molecules, however, can reside in porous wall by replacing the molecules that are trapped in the pores. Moreover, the molecule can escape from the pore and enter the channel becoming a free molecule. After travelling for a period time in the channel, the molecule can enter the pore again. During the molecular movement, the momentum exchange has been implemented not only between fluid molecules and wall but also between the fluid molecules themselves in the pore, and the multi-collision between fluid molecules takes place. The reduced slip velocity at the porous wall results in the larger friction coefficient compared to the smooth surface wall. The molecular boundary condition predicted by Maxwell theory on the smooth surface is no longer valid for flow past the permeable surface, and a novel boundary condition should be introduced.
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Reports on the topic "Novel Molecules"

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Koeffler, H. P. Identification of Novel Secreted Molecules of Prostate Cancer. Fort Belvoir, VA: Defense Technical Information Center, June 1999. http://dx.doi.org/10.21236/ada371233.

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Laws, David Douglas. Novel nuclear magnetic resonance techniques for studying biological molecules. Office of Scientific and Technical Information (OSTI), June 2000. http://dx.doi.org/10.2172/970017.

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Chamovitz, Daniel A., and Zhenbiao Yang. Chemical Genetics of the COP9 Signalosome: Identification of Novel Regulators of Plant Development. United States Department of Agriculture, January 2011. http://dx.doi.org/10.32747/2011.7699844.bard.

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This was an exploratory one-year study to identify chemical regulators of the COP9 signalosome. Chemical Genetics uses small molecules to modify or disrupt the function of specific genes/proteins. This is in contrast to classical genetics, in which mutations disrupt the function of genes. The underlying concept is that the functions of most proteins can be altered by the binding of a chemical, which can be found by screening large libraries for compounds that specifically affect a biological, molecular or biochemical process. In addition to screens for chemicals which inhibit specific biological processes, chemical genetics can also be employed to find inhibitors of specific protein-protein interactions. Small molecules altering protein-protein interactions are valuable tools in probing protein-protein interactions. In this project, we aimed to identify chemicals that disrupt the COP9 signalosome. The CSN is an evolutionarily conserved eight-subunit protein complex whose most studied role is regulation of E3 ubiquitinligase activity. Mutants in subunits of the CSN undergo photomorphogenesis in darkness and accumulate high levels of pigments in both dark- and light-grown seedlings, and are defective in a wide range of important developmental and environmental-response pathways. Our working hypothesis was that specific molecules will interact with the CSN7 protein such that binding to its various interacting proteins will be inhibited. Such a molecule would inhibit either CSN assembly, or binding of CSN-interacting proteins, and thus specifically inhibit CSN function. We used an advanced chemical genetic screen for small-molecule-inhibitors of CSN7 protein-protein interactions. In our pilot study, following the screening of ~1200 unique compounds, we isolated four chemicals which reproducibly interfere with CSN7 binding to either CSN8 or CSN6.
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Mason, Ralph P. Breast Tumor pH: Design, Evaluation, and Application of Novel Reporter Molecules. Fort Belvoir, VA: Defense Technical Information Center, October 2001. http://dx.doi.org/10.21236/ada403387.

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Mason, Ralph P. Breast Tumor pH: Design Evaluation and Application of Novel Reporter Molecules. Fort Belvoir, VA: Defense Technical Information Center, October 2002. http://dx.doi.org/10.21236/ada411792.

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Li, Chenglong, James Fuchs, and Jiayuh Lin. Novel Small Molecules Disabling the IL-6/IL-6R/GP130 Heterohexamer Complex. Fort Belvoir, VA: Defense Technical Information Center, October 2013. http://dx.doi.org/10.21236/ada606135.

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Calin, George A., Shuxing Zhang, and Waldemar Priebe. Targeting Micrornas With Small Molecules: A Novel Approach to Treating Breast Cancer. Fort Belvoir, VA: Defense Technical Information Center, October 2010. http://dx.doi.org/10.21236/ada538185.

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Li, Chenglong, James Fuchs, and Jiayuh Lin. Novel Small Molecules Disabling the IL-6/IL-6R/GP130 Heterohexamer Complex. Fort Belvoir, VA: Defense Technical Information Center, October 2012. http://dx.doi.org/10.21236/ada584824.

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Calin, George A., Shuxing Zhang, and Waldemar Priebe. Targeting MicroRNAs with Small Molecules a Novel Approach to Treating Breast Cancer. Fort Belvoir, VA: Defense Technical Information Center, October 2011. http://dx.doi.org/10.21236/ada555163.

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Forsythe, Eric, Jianmin Shi, and David Morton. Next Generation Highly Conducting Organic Films Using Novel Donor-Acceptor Molecules for Opto-Electronic Applications. Fort Belvoir, VA: Defense Technical Information Center, June 2009. http://dx.doi.org/10.21236/ada499643.

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