Dissertations / Theses on the topic 'Residue conservation'
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Valdar, William Seth Jermy. "Residue conservation in the prediction of protein-protein interfaces." Thesis, University College London (University of London), 2001. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.246927.
Full textLivingstone, Craig David. "Pattern recognition and protein structure prediction from aligned amino acid sequences." Thesis, University of Oxford, 1995. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.297307.
Full textKelton, Jessica Ann Price Andrew J. "Herbicide performance and weed seedbank dynamics as affected by high residue conservation agriculture systems." Auburn, Ala., 2009. http://hdl.handle.net/10415/1929.
Full textJerrell, Scottie Lee. "Strip-Tillage Production Systems for Tobacco." Thesis, Virginia Tech, 2001. http://hdl.handle.net/10919/33132.
Full textMaster of Science
Le, Roux Andries Abraham. "The effect of soil residue cover on medicago pasture establishment and production under conservation agricultural practices." Thesis, Stellenbosch : Stellenbosch University, 2015. http://hdl.handle.net/10019.1/97055.
Full textENGLISH ABSTRACT: Annual medic pastures play an important role in conservation agriculture (CA) practices in the Western Cape, because of the beneficial role it plays in rotation systems and the fact that it can re-establish on its own. In the Overberg medic pastures are the main pasture short rotation crop, but farmers in recent years shifted away from including medics. This was due to unsuccessful re-establishment and a visible decrease in dry matter production. This trend started after CA practices were implemented for a few years. A field study conducted during 2013 investigated medic re-establishment and production following a wheat, barley, oat and medic pasture production year ( WM, BM, OM and MM) of which residues were left on the soil surface at different cover percentage levels (100%, 75%, 50%, 25% and 0%). The objective of this study was to determine what the effect of different amounts of residues was on annual medic re-establishment and production. Data from this study suggest that management of annual medic pastures should aim to re-sow the medic pasture if plant count drops below 78 pants per square meter. Weed management is of cardinal importance as it competes for resources, light and space and decrease medic pasture re-establishment and production. The data also indicates that the wheat/medic sequence is the best option when applying a short cash crop/annual pasture cropping system. Producers should manage their animals to ensure that a 50% to 75% cover is left on top of the soil following the grazing of residues during the summer months. The study in 2013 should have been replicated, but due to the low levels of re-establishment and production a decision was made to re-plant the trial sites. The field study conducted during 2014 investigated the medic/clover establishment and production following a re-plant. Medics were replanted following a W, B, O and M season, respectively. Residues again were manipulated to different cover percentages (100%, 75%, 50%, 25% and 0%). The objective was again to look at the amount and type of residues on medic/clover establishment and production following re-plant. Data from this study indicated that it might be advisable for annual medic/clovers to be re-sown after a cereal production year rather than a medic pasture year. With the production of medic/clover pastures not being affected by the residue cover percentage, a 100% residue cover following re-plant is best in rotations, if the optimal effect of CA wants to be observed. If animals are included in the production cycle, grazing of residues during summer months can occur until 50% cover is left. Soils will take longer to reach its potential, but by including animals the gross margin is more stable year on year. Two supplementary studies were conducted to investigate the germination of annual medics under controlled conditions. The objectives of the first supplementary study was to investigate the physical barrier effect of residues at different percentage cover (100%, 75%, 50%, 25% and 0%) and a possible allelopathic action from different types of residues (wheat, barley, oat and medic) on the annual medic cultivar Cavalier (one of the cultivars used during 2014 field re-plant). The different amounts of residue had no significant effect on percentage emergence of Cavalier. The 0% residue cover having the slightly higher germination could be because there are no physical obstructions preventing seedlings to establish. The different types of residue cover had no significant effect on the germination of annual medics, as the germination under wheat, barley, oats and medic residues did not differ from the control. The control had a slightly higher germination percentage (85%), while germination under residues was just below the recommended germination rate of 80-85%. This could be an indication of allelopathy from residues. The objective of the second supplementary study was to investigate the allelopathic effects of different residue leachates (wheat, barley, oat and medic) at different levels of concentrations (100% leachate, 75%, 50%, 25% and distilled water being the control) on Cavalier germination. The interaction between leachate type and concentration were significant. Low levels of leachate concentration did not have a significant impact on medic germination when compared between each other and the control. When the concentration percentage was increased differences were detected. Cavalier germination decreased drastically when medic leachate concentration increased, indicating allelopathic effects. Cavalier germination followed the same trend, just not as drastic, when wheat leachate concentration increased. This indicates that wheat could also have a negative allelopathic effect. With oat leachate Cavalier germination did not decrease except when 100% concentrate was used, which could indicate a small allelopathic effect. Cavalier germination following barley leachate showed no effect as concentration increased, even showing the odd increase. Depending on repeatability or follow-up studies of these experiments, data suggest that re-plant of medic pastures is beneficial if plant count drops below sustainable levels. Management of weeds during the medic pasture year improves production. Annual medic pastures should be re-planted following a cereal production year rather than a previous pasture year. Thus single medic rotations are preferred, for example WMWM rotation. Greater amounts of residues are beneficial for CA effects, but allelopathic effects of wheat and oat residues should be taken in consideration during re-establishment and residue levels should be lowered.
AFRIKAANSE OPSOMMING: Eenjarige medic weidings speel ʼn belangrike rol in bewaring landbou (CA) praktyke in die Wes Kaap, vanweë sy vermoë om jaarliks op sy eie te hervestig en sy voordelige rol in rotasie stelsels. Eenjarige medic weidings is tans die hoof kort rotasie gewas in die Overberg, maar boere is tans besig om dit uit die rotasie uit te sluit. Dit is as gevolg van lae hervestiging sowel as die opvallende afname in produksie. Hierdie waarnemings het na ʼn paar jaar na die toepassing van CA praktyke begin. Gedurende 2013 is daar ʼn veldstudie voltooi rakende medic weiding hervestiging en produksie wat na ʼn koring, gars, hawer en medic weiding produksie jaar volg (WM, BM, OM en MM). Gedurende die studie is stoppels by verskillende persentasie vlakke van bedekking op die grond gelaat (100%, 75%, 50%, 25% en 0% bedekking). Die doel van die studie was om die invloed van verskillende tipes en hoeveelhede stoppels op die hervestiging en produksie van eenjarige medic weidings vas te stel. Data van hierdie studie dui aan dat jaarlikse medic weidings so bestuur moet word dat medics in die Overberg area se plant telling nie laer as 78 plante per vierkante meter daal nie. Onkruid bestuur is van kardinale belang, omdat dit kompeteer met medics en veroorsaak ʼn verlaging in hervestiging en opbrengs. Data dui ook aan dat ʼn koring/medic stelsel die beste opsie is wanneer ʼn kort kontant gewas/eenjarige weiding gewas stelsel toegepas word. Produsente moet hul vee so bestuur dat ʼn 50 tot 75% stoppel bedekking gedurende die somer maande oorgelaat word na beweiding. Die herhaling van die 2013 veld studie was van plan, maar ag gevolg van lae hervestiging en produksie was die proef kampe oor geplant. Die veldstudie in 2014 was medic/klawer vestiging en produksie na herplanting ondersoek. Die medic/klawer saad is geplant na ʼn koring, gars, hawer en medic weiding seisoen onderskeidelik. Stoppels is weereens na verskillende bedekking persentasies verander (100%, 75%, 50%, 25% en 0% bedekking). Die doel was om te kyk wat die effek van verskillende tipes en hoeveelhede stoppels op eenjarige medic/klawer weiding is na herplant. Data wys dat medic/klawer weidings verkieslik herplant moet word na ʼn graan produksie jaar as ʼn medic weiding produksie jaar. Die medic/klawer weiding is nie geaffekteer deur die hoeveelheid stoppels op die grond oppervlakte nie, dus is ʼn 100% stoppel bedekking verkieslik vir optimale CA effekte. As diere in die sisteem teenwoordig is, kan stoppels bewei word gedurende die somer maande tot ʼn 50% bedekking bereik word. Grond sal langer vat om sy potensiaal te bereik, maar die jaarlikse bruto marge sal meer stabiel wees. Twee aanvullende studies is onderneem en ontkieming van eenjarige medics is ondersoek onder beheerde toestande. Die doelwit van die eerste aanvullende studie was om te kyk na die fisiese versperring effek van stoppels by verskillende persentasie bedekking (100%, 75%, 50%, 25% en 0%) en ʼn moontlike allelopatiese effek van verskillende tipe stoppels (koring, gars, hawer en medic) op die eenjarige medic kultivar Cavalier. Verskillende hoeveelhede stoppels het geen beduidende uitwerking op die vestiging van Cavalier gehad nie. Die 0% stoppel bedekking het ʼn effens hoër vestiging gehad. Dit kon wees as gevolg van geen fisiese versperring wat die saailing verhoed om te vestig nie. Die verskillende tipes stoppels het geen beduidende uitwerking op die ontkieming van eenjarige medics nie, die vestiging onder koring, gars, hawer en medic stoppels het nie statisties verskil van die kontrole nie. Die kontrole het wel ʼn effense hoër persentasie vestiging gehad (85%), terwyl die vestiging onder die stoppels onder die aanbevole koers van 80-85% was. Dit kan dalk ʼn allelopatiese effek van die stoppels aandui. Die doel van die tweede aanvullende studie was om die allelopatiese effek van die verskillende tipes stoppels (koring, gars, hawer en medic) by verskillende vlakke van konsentrasie (100%, 75%, 50%, 25% van die onverdunde loogsel en gedistilleerde water as kontrole) op Cavalier ontkieming. Daar was ʼn beduidende interaksie tussen tipe en konsentrasie loogsel. Met lae konsentrasie vlakke van loogsel was daar nie ʼn werklike impak op Cavalier ontkieming tussen die verkillende tipes en die kontrole nie. Slegs wanneer die konsentrasie persentasie verhoog is, is verskille waargeneem. Cavalier ontkieming het drasties af geneem soos die medic loogsel konsentrasie toegeneem het, wat ʼn negatiewe allelopatiese en verhoogde osmolaliteit effek wys. Cavalier ontkieming het dieselfde tendens gewys wanneer koring loogsel konsentrasie verhoog was, maar nie so drasties soos medic loogsel. Dit dui daarop dat koring ook ʼn negatiewe allelopatiese effek wys. Met hawer loogsel het Cavalier ontkieming slegs by die 100% konsentrasie pyl afgeneem, wat op ʼn lae allelopatiese effek dui. Cavalier ontkieming onder gars loogsel het geen verandering gewys as konsentrasies toegeneem het nie, en het selfs ʼn toename in ontkieming in party gevalle ondergaan. Afhangend van herhaling of op-volg studies van hierdie eksperimente, wys die data dat dit voordelig is om medic weidings te herplant as plant telling onder 78 plante per vierkante meter daal. Die bestuur van onkruid tydens die medic weidings jaar verbeter opbrengs. Eenjarige medic weidings moet herplant word na ʼn graan produksie jaar liewer as ʼn vorige weidings jaar. Medics moet dus in ʼn eenjarige rotasie stelsel wees, byvoorbeeld WMWM rotasie. Meer stoppels is voordelig vir CA promosie, maar allelopatiese stowwe van koring en hawer stoppels moet in ag geneem word en stoppels moet verlaag word vir hervestiging.
Zheng, Baojuan. "Broad-scale Assessment of Crop Residue Management Using Multi-temporal Remote Sensing Imagery." Diss., Virginia Tech, 2012. http://hdl.handle.net/10919/19201.
Full textPh. D.
Dam, Rikke Friis. "Impacts of long term tillage and residue practices on selected soil properties." Thesis, McGill University, 2003. http://digitool.Library.McGill.CA:80/R/?func=dbin-jump-full&object_id=78344.
Full textBurgess, Magdalena S. E. "Crop residue decomposition and nitrogen dynamics in corn under three tillage systems." Thesis, McGill University, 2000. http://digitool.Library.McGill.CA:80/R/?func=dbin-jump-full&object_id=36879.
Full textLynch, Madalyn Josephine. "A Measurement of Conservation Agriculture’s Effect on Nitrogen and Carbon Mineralization Rates for Agricultural Recommendations in Haiti’s Central Plateau." Thesis, Virginia Tech, 2015. http://hdl.handle.net/10919/51620.
Full textMaster of Science
Benson, Gordon Brinkley. "Integration of High Residue/No-till and Farmscaping Systems in Organic Production of Broccoli." Thesis, Virginia Tech, 2006. http://hdl.handle.net/10919/32805.
Full textMaster of Science
Spedding, Timothy Andrew. "Soil microbial dynamics in response to tillage and residue management in a maize cropping system." Thesis, McGill University, 2002. http://digitool.Library.McGill.CA:80/R/?func=dbin-jump-full&object_id=79133.
Full textMashingaidze, Nester. "Weed dynamics in low-input dryland smallholder conservation agriculture systems in semi-arid Zimbabwe." Thesis, University of Pretoria, 2013. http://hdl.handle.net/2263/24412.
Full textThesis (PhD)--University of Pretoria, 2013.
Plant Production and Soil Science
unrestricted
Chan, Pedro. "A computational investigation of solubility, functionality and the adaptation in subcellular compartments of proteins." Thesis, University of Manchester, 2011. https://www.research.manchester.ac.uk/portal/en/theses/a-computational-investigation-of-solubility-functionality-and-the-adaptation-in-subcellular-compartments-of-proteins(29ba40c2-0e8b-459a-803b-529da885289a).html.
Full textAlskaf, Kamal. "Conservation agriculture for sustainable land use : the agronomic and environmental impacts of different tillage practices and plant residue retention : farmer uptake of reduced tillage in England." Thesis, University of Nottingham, 2018. http://eprints.nottingham.ac.uk/51902/.
Full textGraham, Michael William. "Evaluating the interactions of crop management, carbon cycling, and climate using Earth system modeling and remote sensing." Diss., Virginia Tech, 2019. http://hdl.handle.net/10919/102386.
Full textDoctor of Philosophy
Callum, Ian R. "Long-term effects of tillage and residues on selected soil quality parameters." Thesis, McGill University, 2001. http://digitool.Library.McGill.CA:80/R/?func=dbin-jump-full&object_id=31202.
Full textPenick, William Frazier. "Influence of Transplanter Modification and Previous Crop on the Production of No-Till Dark Tobacco." TopSCHOLAR®, 2013. http://digitalcommons.wku.edu/theses/1257.
Full textIllergård, Kristoffer, Anni Kauko, and Arne Elofsson. "Why are polar residues within the membrane core evolutionary conserved?" Stockholms universitet, Institutionen för biokemi och biofysik, 2011. http://urn.kb.se/resolve?urn=urn:nbn:se:su:diva-68378.
Full textauthorCount :3
Purewal, Victoria Jane. "Novel detection and removal of hazardous biocide residues historically applied to herbaria." Thesis, University of Lincoln, 2012. http://eprints.lincoln.ac.uk/13573/.
Full textRicchiuto, Mario. "Construction and analysis of compact residual discretizations for conservation laws on unstructured meshes." Doctoral thesis, Universite Libre de Bruxelles, 2005. http://hdl.handle.net/2013/ULB-DIPOT:oai:dipot.ulb.ac.be:2013/211035.
Full textThe schemes considered belong to the class of residual distribution (RD) or fluctuation splitting (FS) schemes.
The methodology presented relies on three main elements: design of compact linear first-order stable schemes for linear hyperbolic PDEs, a positivity preserving procedure mapping stable first-order linear schemes onto nonlinear second-order schemes with non-oscillatory shock capturing capabilities, and a conservative formulation enabling to extend the schemes to nonlinear CLs. These three design steps, and the underlying theoretical tools, are discussed in depth. The nonlinear RD schemes resulting from this construction are tested on a large set of problems involving the solution of scalar models, and systems of CLs. This extensive verification fills the gaps left open, where no theoretical analysis is possible.
Numerical results are presented on the Euler equations of a perfect gas, on a two-phase flow model with highly nonlinear thermodynamics, and on the shallow-water equations.
On irregular grids, the schemes proposed yield quite accurate and stable solutions even on very difficult computations. Direct comparisone show that these results are more accurate than the ones given by FV and WENO schemes. Moreover, our schemes have a compact nearest-neighbor stencil. This encourages to further develop our approach, toward the design of very high-order schemes, which would represent a very appealing alternative, both in terms of accuracy and efficiency, to now classical FV and ENO/WENO discretizations. These schemes might also be very competitive with respect to very high-order DG schemes.
Doctorat en sciences appliquées
info:eu-repo/semantics/nonPublished
Saini, Monika Van Santen Edzard. "Integration of cover crop residues, conservation tillage and herbicides for weed management in corn, cotton, peanut and tomato." Auburn, Ala, 2009. http://hdl.handle.net/10415/1882.
Full textRicchiuto, Mario. "Contributions to the development of residual discretizations for hyperbolic conservation laws with application to shallow water flows." Habilitation à diriger des recherches, Université Sciences et Technologies - Bordeaux I, 2011. http://tel.archives-ouvertes.fr/tel-00651688.
Full textZimmerman, Kathryn. "Sustaining biological diversity in managed sub-boreal spruce landscapes residual habitat strategies for cavity nesting species /." Connect to this title online, 1998. http://www.nlc-bnc.ca/obj/s4/f2/dsk2/ftp03/MQ62505.pdf.
Full textHaboub, Ahmad. "Essays on equity valuation and accounting conservatism for insurance companies." Thesis, Brunel University, 2017. http://bura.brunel.ac.uk/handle/2438/15823.
Full textIbrahim, Houssam. "Implantation cochléaire sur audition résiduelle : conservation des structures anatomiques neurosensorielles." Thesis, Lyon 1, 2011. http://www.theses.fr/2011LYO10244.
Full textSensorineural deafness is generaly the result of hair cell death and additional degeneration of afferent innervation. In recent years the candidacy criteria for cochlear implantation have been expanding, and now include patients with severe to profound high-frequency hearing loss along with mild to moderate low-frequency loss. The single most important prerequisite for providing both electric and acoustic stimulation in the same ear is the preservation of acoustic hearing following the surgical procedure. Currently, several hearing preservation protocols are under investigation. Each protocol attempts to implement procedures that minimize both immediate and delayed mechanisms. Specifically, atraumatic approaches and electrode insertions (Flex EAS and Flex Soft) have been proposed that aim at minimizing the surgical aspect of intracochlear trauma. The concomitant application local of drugs should enhance tissue tolerability and thus reduce intracochlear damage on a cellular level. Acute and topical, intracochlear drug delivery prior to electrode array insertion with a disposable single-use catheter (Med-El) has been evaluated and developed. The flexible properties of this catheter are enough to be inserted without trauma in the cochlea. Sequential insertion of intracochlear catheters and electrode arrays is feasible and often atraumatic
Ranaivoson, Lalaina. "Etude des fonctions agro-écologiques des principes de l'agriculture de conservation dans l'amélioration de la production du riz pluviale dans la région du lac Alaotra (Madagascar)." Thesis, Montpellier, SupAgro, 2017. http://www.theses.fr/2017NSAM0043/document.
Full textConservation agriculture (CA) is based on the principles of minimum soil disturbance, permanent soil cover and diversification of crop species grown in rotations and/or associations. CA was introduced in the late 90s in the Lake Alaotra region, Madagascar, in order to improve rainfed crop productivity which is commonly constrained by low soil fertility, soil water stress and weed infestation. The main objective of this study was to quantify and understand the impact of CA on rainfed rice productivity as compared to the practice of conventional tillage (CT). First, a review of literature was conducted on the agro-ecological functions of mulching with crop residues in relation to their quantity. The literature review showed that the optimal amount of residues required principally depends on the agro-ecological function searched for. Residue amounts of 2 to 3 t ha-1 had clear positive effects in terms of improving water infiltration and limiting water runoff and soil erosion. On the other hand, results on weed control, nutrient availability and soil fauna in relation to the amount of mulch were highly variable, suggesting the interaction of these agro-ecological functions with other factors, including residue type and soil-climate conditions. Second, two field experiments were monitored at the research center of FOFIFA in the Lake Alaotra region. A first experiment aiming at quantifying the physical effect of a mulch of crop residues on weed infestation, with amounts of surface residues ranging from 0 to 45 t ha-1 showed that the emergence and biomass of weeds on mulched plots depend mainly on the quantity and distribution of rainfall during the cropping season. Overall, weed emergence and biomass decreased with increasing amounts of mulch. However, a large quantity of residues, i.e. in the order of 10 t ha-1, was required to significantly (p<0.05) reduce weed pressure as compared to a bare soil under the agro-ecological conditions of our experiments. The second experiment was conducted during six years (2009/10 to 2014/15), and a 2-year rotation of maize + Dolichos lablab // rice and a 3-year rotation of maize + Stylosanthes guianensis // S. guianensis // rice were combined with three soil/residue management practices and two level of fertilization. Two levels of weed pressure were added as split-plot in 2013/14 and 2014/15. Higher rice grain yields on CA plots as compared to CT plots in the fifth and sixth year of the CA practice were mainly related to a decline of weed pressure under CA. Soil water and mineral nitrogen dynamics did not differ markedly between CA and CT and were strongly influenced by the rainfall pattern. Finally, the use of the concept of stability analysis and the yield gap approach to analyze the variation of rice yield under the 6 crop seasons from 2009/10 to 2014/15 showed that the effects of treatments including crop rotation, soil and residue management, and fertilization levels interact with other factors likely related to the spatial variability of the experimental design. Results of our study suggest that both agro-ecological function of mulch searched for and rainfall conditions should be taken into account when promoting CA systems to improve crop productivity in the Lake Alaotra region. Practicing CA with typical amounts of residues that are produced on farmer’s field (i.e. 1 – 2 t ha-1) is sufficient to control water runoff and soil erosion. However, extra amounts of crop residues are required to effectively control weed infestation. These extra amounts could be produced with the introduction of high biomass-producing crop rotations and could decrease the labor pressure from weeding
PINCHE, CATHERINE. "Mise au point d'une methode de dosage differentiel par chimiluminescence des derives oxygenes de l'azote dans les produits de charcuterie et salaisons. Etude de l'incidence des modalites de fabrication et de conservation sur les taux residuels de nitrite et des derives nitroses." Clermont-Ferrand 2, 1990. http://www.theses.fr/1990CLF21149.
Full textRamsamy, Priscilla. "Modélisation de la morphodynamique sédimentaire par une méthode distribuant le résidu." Thesis, Antilles, 2017. http://www.theses.fr/2017ANTI0206/document.
Full textThe present work, proposes a high order Residual Distribution (RD) numericalscheme to solve the non conservative hyperbolic problem, coupling Shallow Water and Grass equations. It uses Total Value Diminishing Runge Kutta and stabilisation Upwind methods, with or without limiters. It also has some good properties.A part of the work realised in this thesis, is about the conception and the developpement of a 2D-space Python program, under the form of a software,using a set of moduls created for the occasion. the code developpement, whichis said to approach the _uid-sediment model, coupling Shallow-Water and sedimentequations, has been made with an Object orientation and in orderto be e_cient on parallel architecture (using multithreads OpenMP parallelism). One of the features of the scheme in this case, is due to its application on quadrangles.A 1D-space program, also writen as a software, has been estabished. In order to be portable and e_cient, It has been developped multilinguals (Python- Fortran : by numpy.ctypes for Python and by standart interface FORTRAN for C). The RD scheme with or without Flux Limiters, has been implemented like predictor-corrector one. Comparisons with other schemes results have been realised, in order to show its e_ciency, moreover its high order accuracy has been focus on, and the C-proprerty has been tested. The tests show that MUSCL MinMod _ux limiters, is the most adaptated for a dune test case, between all tested.In the scalar case, numerical tests have been realised, for validating the secondorder of accuracy
Larat, Adam. "Conception et Analyse de Schémas Distribuant le Résidu d'Ordre Très Élevé. Application à la Mécanique des Fluides." Phd thesis, Université Sciences et Technologies - Bordeaux I, 2009. http://tel.archives-ouvertes.fr/tel-00502429.
Full textWilson, Andrew S., N. Tuross, and M. J. Wachowiak. "Blood Residues on Archaeological Objects - A Conservation Perspective." 1996. http://hdl.handle.net/10454/10973.
Full textChen, Ya-Ping, and 陳雅萍. "Analyzing the Impacts of Sequence Conservation on Protein RNA-binding Residue Prediction." Thesis, 2011. http://ndltd.ncl.edu.tw/handle/21582511879129142405.
Full text國立臺灣大學
工程科學及海洋工程學研究所
99
Protein-RNA interactions play a vital role in many stages of gene expression such as pre-mRNA synthesis, mRNA splicing and translation. It is generally believed that binding domains or binding motifs enable RNA-binding proteins to recognize their target RNA. Since the corresponding nucleic acid type and the structure level recognized can be quite diverse, predicting RNA-binding residues from primary structure of proteins is indeed a challenging task. In this thesis, we continue the work of ProteRNA and develop two classifiers, namely support vector machine (SVM) and random forests (RF), with the predicted protein disorder added as a new feature descriptor. For the post-processing procedure, we build a discriminator in order to improve the pattern quality by distinguishing RNA-binding residues from other functionally important ones in conserved regions. When considering the dataset preparation effects and variance in binding sites, the two classifiers achieve Matthew’s correlation coefficient (MCC) of 0.5288 and 0.4698 using five-fold cross-validation. Our approach outperforms other predictors which provide online service. Testing on the independent test dataset, the SVM model achieves an accuracy of 92.12%, sensitivity of 38.10%, specificity of 97.47%, precision of 59.89%, F-score of 0.4657 and MCC of 0.4381, while the RF model ranks second only to SVM, it achieves an accuracy of 90.08%, sensitivity of 34.47%, specificity of 95.59%, precision of 43.62%, F-score of 0.3851 and MCC of 0.3346. We observe the measure trend in machine learning methods for datasets based on different sequence identities, and discuss the origin of performance increment and bottleneck. We find out that the homologous sequence, or even remote homologous in the same dataset as query sequence will probably make prediction result closer to the distribution of real binding sites. Besides, a method that identifies the nearest neighbor by sequence alignment and determines its binding residues accordingly may perform better than machine learning methods trained on PSSM in some cases. Nevertheless, when dealing with novel protein sequences, the excellent performance of machine learning methods shows great generalization ability.
Liu, Jen-Wei, and 劉人維. "Comprehensive Analysis of Residue Structural Environments, Conservation and Their Applications in Proteins." Thesis, 2017. http://ndltd.ncl.edu.tw/handle/x69dq9.
Full text國立交通大學
生物資訊及系統生物研究所
105
Functionally or structurally important residues such as catalytic sites in a protein are usually evolutionary conserved. To identify these conserved residues, a set of homolog sequences are generally used to calculate sequence conservation scores. Interestingly, the sequence conservation scores were found to be highly correlated with residue structural environments in a protein structure. Therefore, we could estimate evolutionary information from a single protein structure even without information from homolog proteins. In 2008, our lab proposed a residue structural environment of the WCN model, which can describe the packing extent of every residue in a protein structure. The WCN model was then used to explore the relationships between protein structure and sequence conservation in 2012. Recently, we proposed another structural model named relative space of Voronoi volume (RSV), which describes available space for every residue. RSV is only affected by nearest residues while WCN considers longer-range interactions. We will focus on RSV and WCN models in this thesis. Moreover, solvent exposure, depth, dynamic properties, or more sophisticated interactions of van der Waals or electrostatic force in protein structures will be introduced. With these structural descriptors, we can quantify the residue-level information with a number representing structural environments. Using the dataset of 554 enzymes, we explore the relationships between all structural environments and sequence conservation. Furthermore, we could use these relationships to identify functionally important residues or assess the quality of a protein model. With such detailed analysis of structural environments in this study, we believe there will be more applications for structural environments related to protein functionality, protein stability, structure prediction, or protein evolution in future research.
Huang, Yu-Wen, and 黃郁文. "On the relationship between structural packing and residue conservation in protein-protein interfaces." Thesis, 2017. http://ndltd.ncl.edu.tw/handle/h5q83x.
Full text國立交通大學
生物資訊及系統生物研究所
105
Proteins interact with other proteins to perform their biological functions. Thus, the knowledge of protein-protein interfaces is valuable in understanding molecular mechanisms. Recently, we have observed that structural packing profiles of proteins have moderate correlations with their corresponding conservation profiles. However, some proteins were found to have low correlations between these two profiles, where structural packing profiles of the proteins were computed using a weighted contact number (WCN) model with the structures of single proteins. To better understand the characteristics in protein-protein interfaces, we explored the relationship between structural packing and residue conservation in protein-protein interfaces from 344 non-homologous subunits of 328 enzymes complexes. These subunits compose three datasets: Set I, Set A, and Set B. In Set A, catalytic sites of complexes are in the interfaces and consist of residues from multiple subunits; in Set B, catalytic sites of complexes are not in the interfaces and consist of residues from single subunits. We found that interface residues in three datasets tend to have high WCN scores (i.e., low structural packing). However, interface residues of Set B tend to have high conservation scores (i.e., lowly conserved). The tendency is different from those of the other datasets. This could be that complexes of Set B have weaker functional and structural constraints on their evolutionary processes than those of the other datasets in the condition that the enzymatic functions of the complexes are maintained. Surprisingly, the results show that the interface residues have distinct distributions of differences between the WCN scores and the conservation scores from the non-interface residues. Also, the WCN scores of the interface residues tend to be higher than their corresponding conservation scores. Furthermore, using a difference between a WCN score and a conservation score of a residue to detect the protein-protein interfaces, noteworthy sensitivity was obtained. This study provides interface properties in structural packing and residue conservation and elucidates the relationship between the structural packing and the residue conservation in interfaces of individual subunits.
Lin, Yu-Feng, and 林玉鳳. "On the relationship between protein structures, packing density, and residue conservation of protein domains." Thesis, 2017. http://ndltd.ncl.edu.tw/handle/3f7uch.
Full text國立交通大學
生物資訊及系統生物研究所
105
During evolution, substitutions at individual residues within amino acid sequences arise under the constraints of structure folding, protein function, and the protein–protein interactions. Amino acid sequences generally fold into unique, stable, and well-ordered conformations so that the resulting proteins can carry out their specific functions. As such, residues that are important for function and structural stabilization are generally highly conserved in terms of both sequence and structure. Recent studies have discussed the structural constraints imparted by site-specific substitutions, and amino acid sequence conservation was found to correlate with solvent accessibility and the local packing density such as weighted contact number. The relationship between sequence conservation, site-specific substitution rates derived from multiple sequence alignment, and the weighted contact number, local packing density derived from three-dimensional structure, revealed that the evolution constraint of protein sequence and structure properties were correlated. In this study, we assessed the relationship between the packing density profiles drawn out from similar protein domain structures in SCOP superfamily with the relationship of remote homologs, and the results showed that similar structures had similar weighted contact number profiles, and demonstrated that the packing density profiles could reflect the structural constraints. Then, we compared the site-specific substitution rate profiles of two proteins and their structures, and the results showed that similar conservation profiles could be linked to similar structures. The evolution constraints of protein sequence and structure were not only related to each other in a protein, but also were interrelated in different proteins. The protein sequence and structure restricted by evolution constraints lead to that the binding regions tend to be conserved in sequence and structure and the interacting residues involved are usually in close three-dimensional space. In this study, we analyzed the protein structure, local packing density and residue constitute of metal ion-binding sites, including Ca2+, Cu2+, Cu+, Fe3+, Fe2+, Mg2+, Mn2+, Zn2+, Cd2+, Ni2+, Hg2+, and Co2+. The analysis of local packing density of metal ion-binding sites revealed that the metal ion-binding sites tend to be more crowded in proteins. Our result showed that the distributions of local packing density of metal ion-binding residues were distinct from those of non-metal ion-binding residues. The results showed that there were distinct different binding patterns of these twelve kinds of metal ion-binding sites, indicating the conservation of structure and sequence in metal ion-binding residues. According to the conserved patterns of structure and residue, we further developed a method to predict the metal ion-binding residues and build the model of metal ions docking by using fragment transformation method, and built up the MIB server (Metal Ion Binding sites prediction and docking server, http://bioinfo.cmu.edu.tw/MIB/) for not only twelve metal ion–binding sites prediction but also metal ions docking.
Cheng, Chih-Wen, and 鄭智文. "The relationship between the free space and the conservation of residues in a protein." Thesis, 2015. http://ndltd.ncl.edu.tw/handle/83823746721434549107.
Full text國立交通大學
生物資訊及系統生物研究所
103
蛋白質序列中序列保留性高的氨基酸常常在功能上或結構上是重要的. 每個氨基酸在序列保留的程度上通常會受到它們的本身的物理性質所影響. 其中一個性質是緊湊的蛋白質結構中的自由空間. 在這次的研究中, 我們提出一個基於Voronoi體積的方法來量化氨基酸周圍的自由空間, 名叫Relative Space of Voronoi (RSV). 根據計算序列保留度和結構特性的相關係數, 結果顯示沿著序列上的氨基酸其序列保留度上的變化和RSV有很好的相關性. 我們的結果提出另一種方式來研究序列保留度和結構特性之間的關係.
Chwialkowski, Natalia Ewa. "Novel approaches in determining baseline information on annual disposal rates and trace element content of U.S. coal combustion residues : a response to EPA’s June 2010 proposed disposal rule." Thesis, 2010. http://hdl.handle.net/2152/ETD-UT-2010-12-2386.
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