Academic literature on the topic 'CPMD'

Create a spot-on reference in APA, MLA, Chicago, Harvard, and other styles

Select a source type:

Consult the lists of relevant articles, books, theses, conference reports, and other scholarly sources on the topic 'CPMD.'

Next to every source in the list of references, there is an 'Add to bibliography' button. Press on it, and we will generate automatically the bibliographic reference to the chosen work in the citation style you need: APA, MLA, Harvard, Chicago, Vancouver, etc.

You can also download the full text of the academic publication as pdf and read online its abstract whenever available in the metadata.

Journal articles on the topic "CPMD"

1

Putra, Achmad Noerkhaerin, Unah Indayah, Nokiyah Nokiyah, and Mas Bayu Syamsunarno. "Improving quality of cassava peel meal as raw material for tilapia feed." Depik 11, no. 3 (2022): 319–26. http://dx.doi.org/10.13170/depik.11.3.24620.

Full text
Abstract:
Cassava peel meal (CPM) has potential as a raw material for fish feed due to its abundant availability and good nutritional content. The high crude fiber content inhibits the use of CPM as a raw material for fish feed. Therefore, this study aims to evaluate the effect of Aspergillus niger fermentation of CPM on dietary nutrient digestibility and growth performance of tilapia (Oreochromis niloticus). It was conducted in 2 stages. The first stage was a fermentation process of CPM, which used a factorial randomized design consisting of a dose difference of A. niger, namely 10, 15, 20, 30 g.kg-1 a
APA, Harvard, Vancouver, ISO, and other styles
2

Huang, Qingxiang, and Jian Cao. "Research on Coal Pillar Malposition Distance Based on Coupling Control of Three-Field in Shallow Buried Closely Spaced Multi-Seam Mining, China." Energies 12, no. 3 (2019): 462. http://dx.doi.org/10.3390/en12030462.

Full text
Abstract:
In order to explore the rational coal pillar malposition distance (CPMD) based on coupling control of stress field, displacement field and fracture field (three-field) in shallow buried closely spaced multi-seam (SBCSM-S) mining, and realize coupling control of underground concentrated stress and ground surface fractures, taking the No. 1–2 and No. 2–2 coal seams mining in the northward east area of Ningtiaota coal mine as background, through physical simulation and theoretical analysis, the three-field evolution in SBCSM-S mining was analysed, the effect of different CPMD on coal pillar conce
APA, Harvard, Vancouver, ISO, and other styles
3

Lemke, Kono H. "Structure and solvation dynamics of the hydroxide ion in ice-like water clusters: a CCSD(T) and car–parrinello molecular dynamics study." Physical Chemistry Chemical Physics 23, no. 34 (2021): 18990–98. http://dx.doi.org/10.1039/d1cp02524d.

Full text
APA, Harvard, Vancouver, ISO, and other styles
4

Mosconi, Edoardo, Claudio Quarti, Tanja Ivanovska, Giampiero Ruani, and Filippo De Angelis. "Structural and electronic properties of organo-halide lead perovskites: a combined IR-spectroscopy and ab initio molecular dynamics investigation." Phys. Chem. Chem. Phys. 16, no. 30 (2014): 16137–44. http://dx.doi.org/10.1039/c4cp00569d.

Full text
APA, Harvard, Vancouver, ISO, and other styles
5

Frank, Irmgard. "Some simple facts about water: CPMD simulation." Molecular Physics 118, no. 21-22 (2020): e1802074. http://dx.doi.org/10.1080/00268976.2020.1802074.

Full text
APA, Harvard, Vancouver, ISO, and other styles
6

Nelissen, Geoffrey, Konstantinos Bletsas, and Joël Goossens. "CPMD-mindful task assignment for NPS-F." Real-Time Systems 50, no. 5-6 (2014): 585–91. http://dx.doi.org/10.1007/s11241-014-9206-8.

Full text
APA, Harvard, Vancouver, ISO, and other styles
7

Tilocca, Antonio, and Alastair N. Cormack. "The initial stages of bioglass dissolution: a Car–Parrinello molecular-dynamics study of the glass–water interface." Proceedings of the Royal Society A: Mathematical, Physical and Engineering Sciences 467, no. 2131 (2011): 2102–11. http://dx.doi.org/10.1098/rspa.2010.0519.

Full text
Abstract:
The initial dissolution stages following implantation of a biomaterial in a physiological environment are critical for its bioactive properties. Car–Parrinello molecular-dynamics (CPMD) simulations of the interface between the 45S5 bioglass surface and liquid water have been carried out to investigate these processes. The analysis of a 40 ps CPMD trajectory has highlighted the potential mechanism of Na + /H + exchange, leading to formation of surface silanols through water dissociation. Moreover, by comparing the properties of water layers arranged at different distances from the glass surface
APA, Harvard, Vancouver, ISO, and other styles
8

Bühl, Michael. "Structure and stability of aquotetrafluorouranyl(VI) in the solid state — Density functional study of [UO2F4(H2O)][NMe4]2·2H2O,." Canadian Journal of Chemistry 87, no. 7 (2009): 818–23. http://dx.doi.org/10.1139/v08-182.

Full text
Abstract:
Periodic density functional computations have been performed for solid [UO2F4(H2O)][NMe4]2·2H2O at the BLYP level. A model with disordered fluoro and aquo ligands in the uranyl anion is significantly lower in energy than one with a symmetrical assignment of these sites, which was favored in the original X-ray crystallography study. According to optimized energies and Car–Parrinello molecular dynamics (CPMD) simulations, the [UO2F4(H2O)]2− ion in the solid is stable with respect to loss of the coordinated water molecule. In contrast, CPMD simulations had found this ligand to be unbound in aqueo
APA, Harvard, Vancouver, ISO, and other styles
9

Yu, Shi, Ruizhi Chu, Xiao Li, Guoguang Wu, and Xianliang Meng. "Combined ReaxFF and Ab Initio MD Simulations of Brown Coal Oxidation and Coal–Water Interactions." Entropy 24, no. 1 (2021): 71. http://dx.doi.org/10.3390/e24010071.

Full text
Abstract:
In this manuscript, we use a combination of Car–Parrinello molecular dynamics (CPMD) and ReaxFF reactive molecular dynamics (ReaxFF-MD) simulations to study the brown coal–water interactions and coal oxidation. Our Car–Parrinello molecular dynamics simulation results reveal that hydrogen bonds dominate the water adsorption process, and oxygen-containing functional groups such as carboxyl play an important role in the interaction between brown coal and water. The discrepancy in hydrogen bonds formation between our simulation results by ab initio molecular dynamics (CPMD) and that by ReaxFF-MD i
APA, Harvard, Vancouver, ISO, and other styles
10

Jezierska, Aneta, Kacper Błaziak, Sebastian Klahm, Arne Lüchow, and Jarosław J. Panek. "Non-Covalent Forces in Naphthazarin—Cooperativity or Competition in the Light of Theoretical Approaches." International Journal of Molecular Sciences 22, no. 15 (2021): 8033. http://dx.doi.org/10.3390/ijms22158033.

Full text
Abstract:
Non-covalent interactions responsible for molecular features and self-assembly in Naphthazarin C polymorph were investigated on the basis of diverse theoretical approaches: Density Functional Theory (DFT), Diffusion Quantum Monte Carlo (DQMC), Symmetry-Adapted Perturbation Theory (SAPT) and Car-Parrinello Molecular Dynamics (CPMD). The proton reaction paths in the intramolecular hydrogen bridges were studied. Two potential energy minima were found indicating that the proton transfer phenomena occur in the electronic ground state. Diffusion Quantum Monte Carlo (DQMC) and other levels of theory
APA, Harvard, Vancouver, ISO, and other styles
More sources

Dissertations / Theses on the topic "CPMD"

1

Heßke, Holger. "Car-Parrinello Moleküldynamik-Simulationen zur Hydratisierung und Protonierung von Aminen." Doctoral thesis, Saechsische Landesbibliothek- Staats- und Universitaetsbibliothek Dresden, 2008. http://nbn-resolving.de/urn:nbn:de:bsz:14-ds-1200758724333-78070.

Full text
Abstract:
Ziel dieser Arbeit war die Untersuchung des Hydratationsverhaltens von alkylsubstituierten Aminen und deren korrespondierenden Ammoniumionen mit Hilfe von Car-Parrinello-Moleküldynamik Simulationen (CPMD). Dabei konnten Fragestellungen hinsichtlich der Koordinationszahlen, des Lösungsmittelaustausches und der molekülspezifischen pKB-Werte beantwortet werden. Des Weiteren lässt die Arbeit Aussagen über einen Zusammenhang von Hydratation und anormaler Basiszitätsreihenfolge der Amine zu und ermöglicht zusätzlich die Beschreibung von Systemen mit mehreren Aminfunktionen durch die Anwendung der ge
APA, Harvard, Vancouver, ISO, and other styles
2

Heßke, Holger. "Car-Parrinello Moleküldynamik-Simulationen zur Hydratisierung und Protonierung von Aminen." Doctoral thesis, Technische Universität Dresden, 2007. https://tud.qucosa.de/id/qucosa%3A24040.

Full text
Abstract:
Ziel dieser Arbeit war die Untersuchung des Hydratationsverhaltens von alkylsubstituierten Aminen und deren korrespondierenden Ammoniumionen mit Hilfe von Car-Parrinello-Moleküldynamik Simulationen (CPMD). Dabei konnten Fragestellungen hinsichtlich der Koordinationszahlen, des Lösungsmittelaustausches und der molekülspezifischen pKB-Werte beantwortet werden. Des Weiteren lässt die Arbeit Aussagen über einen Zusammenhang von Hydratation und anormaler Basiszitätsreihenfolge der Amine zu und ermöglicht zusätzlich die Beschreibung von Systemen mit mehreren Aminfunktionen durch die Anwendung der ge
APA, Harvard, Vancouver, ISO, and other styles
3

Wang, S. Q. "Car-Parrinello Molecular Dynamics of Nanosized Graphene Sheets." Thesis, Sumy State University, 2013. http://essuir.sumdu.edu.ua/handle/123456789/35242.

Full text
Abstract:
Car-Parronello molecular dynamics simulations of twelve nanosized graphene sheets with a dozen to a hundred carbon atoms are performed using a mixed Gaussian and planewave approach within the frame-work of the density-functional theory. Two different origins for the rippled structure of graphene are found: the thermodynamic vibration of atoms and the local lattice defect. We suggest that the lattice defect, which changes the local atomic bonding state, should be responsible for the intrinsic ripples in graphene sheet. When you are citing the document, use the following link http://essuir.sumdu
APA, Harvard, Vancouver, ISO, and other styles
4

Patel, Chandan. "Hybrid molecular simulations of oxidative complex lesions." Thesis, Lyon, École normale supérieure, 2013. http://www.theses.fr/2013ENSL0835.

Full text
Abstract:
L'ADN est en permanence exposé à un grand nombre d'événements dommageables déclenchées par des agents endogènes et exogènes. De nombreux travaux expérimentaux ont fourni des informations cruciales sur les propriétés structurelles et la réparation de certains des lésions de l'ADN. Cependant, il manque une vision mécanistique ou énergétique sur leur formation. La biochimie computationnelle a émergé comme un outil puissant pour comprendre les réactions biochimiques et les propriétés électroniques de systèmes complexes.Dans cette thèse, nous étudions la formation de lésions complexes intra-brin et
APA, Harvard, Vancouver, ISO, and other styles
5

Coiffier, Claire. "Approche Top-down pour la synthèse de substrats biologiquement actifs : analyse des conformations préférentielles de C-furanosides à l'aide de la chimie théorique." Thesis, Reims, 2011. http://www.theses.fr/2011REIMS021/document.

Full text
Abstract:
Dans notre laboratoire rémois, le travail sur les sucres est à la base de toutes les recherches, que ce soit pour la synthèse de molécules d'intérêt biologique telles que des analogues du KRN 7000 (un glycolipide présentant une activité antitumorale), ou encore la mise en place de stratégies de synthèse (avec par exemple la stratégie NOE : addition nucléophile stéréosélective suivie d'une ouverture intramoléculaire régiosélective d'un époxyde). Mon trravail a consisté à étudier la flexibilité, et donc les conformations stables ou moins stables, de petites molécules que sont les C-furanosides,
APA, Harvard, Vancouver, ISO, and other styles
6

Dupuis, Romain. "Calculs réalistes du fractionnement isotopique du silicium et du lithium pour des équilibres impliquant des phases liquides." Toulouse 3, 2014. http://thesesups.ups-tlse.fr/2732/.

Full text
Abstract:
Le fractionnement des isotopes est utilisé comme marqueur d'évènements géochimiques pour de multiples applications. Les calculs permettent d'expliquer et de quantifier les mécanismes de fractionnement pour des conditions parfois difficiles à atteindre expérimentalement ; ils permettent de décomposer les mécanismes sous-jacents responsables du fractionnement mesuré. Au cours de cette étude, nous nous sommes intéressés aux isotopes du silicium - dans le quartz, la kaolinite, H4SiO4,aq et H3SiO4,aq - et du lithium - dans Li2O, la polylithionite et Li+ en solution. Nous avons mis en place des appr
APA, Harvard, Vancouver, ISO, and other styles
7

Merchant, Alexander Raymond. "An investigation of carbon nitride." Thesis, The University of Sydney, 2001. http://hdl.handle.net/2123/832.

Full text
Abstract:
This thesis employs experimental and theoretical methods to characterise carbon nitride solids and proposes a generalstructural model for amorphous carbon nitride (a-C:N). It finds that a-C:N deposited by several methods is essentially identical, with similar bonding environments for carbon and nitrogen atoms. Using evidence from several techniques, the saturation of nitrogen in an sp2 carbon matrix is discussed. The experimental studies on a range of carbon nitride solids show no evidence for a crystalline form of carbon nitride. In addition to the experimental characterisation of a-C:N, ab i
APA, Harvard, Vancouver, ISO, and other styles
8

Merchant, Alexander Raymond. "An investigation of carbon nitride." University of Sydney. Physics, 2001. http://hdl.handle.net/2123/832.

Full text
Abstract:
This thesis employs experimental and theoretical methods to characterise carbon nitride solids and proposes a generalstructural model for amorphous carbon nitride (a-C:N). It finds that a-C:N deposited by several methods is essentially identical, with similar bonding environments for carbon and nitrogen atoms. Using evidence from several techniques, the saturation of nitrogen in an sp2 carbon matrix is discussed. The experimental studies on a range of carbon nitride solids show no evidence for a crystalline form of carbon nitride. In addition to the experimental characterisation of a-C:N, ab i
APA, Harvard, Vancouver, ISO, and other styles
9

Bouzid, Assil. "First-principles investigation of binary and ternary amorphous chalcogenide systems." Thesis, Strasbourg, 2014. http://www.theses.fr/2014STRAE029/document.

Full text
Abstract:
Ce travail de thèse s’inscrit dans le cadre d'études théoriques ayant pour but l’établissement de la structure des chalcogénures binaires et ternaires sous différentes conditions thermodynamiques. Des techniques de modélisation numérique ab-initio ont été employées. En particulier, nous avons utilisé la dynamique moléculaire par premiers principes selon l’approche de Car et Parrinello ainsi que sa version dite "deuxième génération". La première partie est consacrée à l’étude des chalcogénures binaires, notamment les verres GeSe2 et GeSe4 sous pression ainsi qu'à l’étude des effets des forces d
APA, Harvard, Vancouver, ISO, and other styles
10

Holroyd, Leo. "Mutagenicity of 5-bromouracil : quantum chemical study." Thesis, University of St Andrews, 2015. http://hdl.handle.net/10023/7063.

Full text
Abstract:
This thesis describes a computational investigation of the mutagenicity of 5-bromouracil (BrU). In Chapter 1, three models of spontaneous and BrU-induced base mispairing (rare tautomer, wobble pair, and ion) are reviewed. Chapter 2 presents the computational techniques used: electronic structure methods (Hartree–Fock-based and density functional theory) and molecular dynamics. Chapter 3 presents optimisations of the keto and enol tautomers of BrU and uracil (U) in water clusters. The enol tautomer of BrU is found to be more stable than that of U. Chapter 4 is a molecular dynamics study of the
APA, Harvard, Vancouver, ISO, and other styles
More sources

Books on the topic "CPMD"

1

Teracine, Edson Baptista, Renata Cristina Bigaram Della Volpe, and Fernando Luis de Castro Miquelino. CPqD 30 anos. CPqD, 2006.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
2

plc, Barbour Index, ed. CPD briefing. Barbour Index plc, 1997.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
3

plc, Barbour Index, ed. CPD briefing. Barbour Index plc, 1995.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
4

plc, Barbour Index, ed. CPD briefing. Barbour Index plc, 1999.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
5

plc, Barbour Index, ed. CPD briefing. Barbour Index plc, 1996.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
6

British Library. Dept. of Printed Books. CPM plus. Bowker-Saur, 1993.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
7

Physiotherapy, Chartered Society of, ed. The CPD process. Chartered Society of Physiotherapy, 2000.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
8

Azambuja, Jocelin. CPMs & APMs: Uma revolução comunitária. EdiPUCRS, 2008.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
9

United States. Administrative Office of the United States Courts. Human Resources Division., ed. Court personnel management systems: CPMS. The Division, 1993.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
10

United States. Administrative Office of the United States Courts. Human Resources Division, ed. CPMS: Court Personnel Management System. Administrative Office of the U.S. Courts, Human Resources Division, 1993.

Find full text
APA, Harvard, Vancouver, ISO, and other styles
More sources

Book chapters on the topic "CPMD"

1

Mohammad, Yasser, Yoshimasa Ohmoto, and Toyoaki Nishida. "CPMD: A Matlab Toolbox for Change Point and Constrained Motif Discovery." In Advanced Research in Applied Artificial Intelligence. Springer Berlin Heidelberg, 2012. http://dx.doi.org/10.1007/978-3-642-31087-4_13.

Full text
APA, Harvard, Vancouver, ISO, and other styles
2

Ma, Teng, Aurelien Bouteiller, George Bosilca, and Jack J. Dongarra. "Impact of Kernel-Assisted MPI Communication over Scientific Applications: CPMD and FFTW." In Recent Advances in the Message Passing Interface. Springer Berlin Heidelberg, 2011. http://dx.doi.org/10.1007/978-3-642-24449-0_28.

Full text
APA, Harvard, Vancouver, ISO, and other styles
3

Weber, Valéry, A. Cristiano I. Malossi, Ivano Tavernelli, et al. "First Experiences with ab initio Molecular Dynamics on OpenPOWER: The Case of CPMD." In Lecture Notes in Computer Science. Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-46079-6_16.

Full text
APA, Harvard, Vancouver, ISO, and other styles
4

McIntosh, Lawrence. "CPMG." In Encyclopedia of Biophysics. Springer Berlin Heidelberg, 2013. http://dx.doi.org/10.1007/978-3-642-16712-6_320.

Full text
APA, Harvard, Vancouver, ISO, and other styles
5

Bass, R. "EEC/CPMP." In The Contribution of Acute Toxicity Testing to the Evaluation of Pharmaceuticals. Springer Berlin Heidelberg, 1986. http://dx.doi.org/10.1007/978-3-642-70390-4_8.

Full text
APA, Harvard, Vancouver, ISO, and other styles
6

Hewett, Victoria. "CPD." In Making it as a Teacher. Routledge, 2019. http://dx.doi.org/10.4324/9780429489341-16.

Full text
APA, Harvard, Vancouver, ISO, and other styles
7

Peters, Nils, Martin Dichgans, Sankar Surendran, et al. "CPM." In Encyclopedia of Molecular Mechanisms of Disease. Springer Berlin Heidelberg, 2009. http://dx.doi.org/10.1007/978-3-540-29676-8_8218.

Full text
APA, Harvard, Vancouver, ISO, and other styles
8

Carter, Judith. "CPD." In SEND Leadership. Routledge, 2025. https://doi.org/10.4324/9781003408994-9.

Full text
APA, Harvard, Vancouver, ISO, and other styles
9

Al-Tubaikh, Jarrah Ali. "CPPD and HADD." In Internal Medicine. Springer Berlin Heidelberg, 2010. http://dx.doi.org/10.1007/978-3-642-03709-2_47.

Full text
APA, Harvard, Vancouver, ISO, and other styles
10

Ishima, Rieko. "CPMG Relaxation Dispersion." In Protein Dynamics. Humana Press, 2013. http://dx.doi.org/10.1007/978-1-62703-658-0_2.

Full text
APA, Harvard, Vancouver, ISO, and other styles

Conference papers on the topic "CPMD"

1

Zhong, Yao, Ming Cui, Wei Pan, and Wei Luo. "CPLD Implementation of Data Demultiplexing." In 2024 IEEE 4th International Conference on Information Technology, Big Data and Artificial Intelligence (ICIBA). IEEE, 2024. https://doi.org/10.1109/iciba62489.2024.10868023.

Full text
APA, Harvard, Vancouver, ISO, and other styles
2

Xu, Jiawei, Nan Cui, Hu Zhang, Xiaoguang Zhang, and Xiaosheng Xiao. "Principal modes of multimode fibers resisting fiber bending." In CLEO: Applications and Technology. Optica Publishing Group, 2024. http://dx.doi.org/10.1364/cleo_at.2024.jw2a.62.

Full text
Abstract:
We demonstrate that multimode fibers possess curved principal modes (CPMs) that can withstand significant fiber bending. These CPMs, derived from an extension of the Wigner-Smith operator, exhibit excellent bending resistance even in arbitrarily shaped fibers.
APA, Harvard, Vancouver, ISO, and other styles
3

Jing, Tao, Feng Yuan, Siyuan Hou, and Lingqin Bai. "CPLD-Based Measurement of FPGA Boot Time." In 2024 3rd International Symposium on Semiconductor and Electronic Technology (ISSET). IEEE, 2024. https://doi.org/10.1109/isset62871.2024.10779629.

Full text
APA, Harvard, Vancouver, ISO, and other styles
4

Hui, Wallace, and Kono Lemke. "Gold(I)-sulfite Complexation in Hydrothermal Fluids: a CPMD Study." In Goldschmidt2023. European Association of Geochemistry, 2023. http://dx.doi.org/10.7185/gold2023.19476.

Full text
APA, Harvard, Vancouver, ISO, and other styles
5

Rodrigues, Allane C. C., Priscila Gomes, Ademir João Camargo, and Heibbe C. B. Oliveira. "Estudo da Energia Livre de Formação das Ligações de Hidrogênio da Dopamina em Solução Aquosa Usando CPMD." In VIII Simpósio de Estrutura Eletrônica e Dinâmica Molecular. Universidade de Brasília, 2020. http://dx.doi.org/10.21826/viiiseedmol2020105.

Full text
Abstract:
Dopamine is an important neurotransmitter belonging to the catecholamine family, which acts on the central nervous system. This catecholamine plays a key role in regulating a variety of functions, such as motor and cognitive functions. This class of neurotransmitters is important for normal neurophysiology and is also the target of a broad spectrum of therapeutic and illicit agents. Evaluating the interaction of these neurotransmitters, in particular, dopamine with water molecules, is crucial for a better understanding of the conformational preferences of dopamine in solution, which consequent
APA, Harvard, Vancouver, ISO, and other styles
6

Hao, Guangbo, and Xianwen Kong. "A 3-DOF Translational Compliant Parallel Manipulator Based on Flexure Motion." In ASME 2009 International Design Engineering Technical Conferences and Computers and Information in Engineering Conference. ASMEDC, 2009. http://dx.doi.org/10.1115/detc2009-86075.

Full text
Abstract:
This paper presents a novel class of 3-DOF translational compliant parallel manipulators (CPMs) based on flexure motion. The analytic mathematic modeling of CPMs is first developed. The analysis of CPMs is then implemented. It is shown that the proposed CPMs have many characteristics such as large range of motion, negligible cross-axis coupling, actuator complete isolation, and no loss motion and no rotational yaw. The inverse relationships of force-displacement of the 3-DOF CPM are further derived to calculate the input forces required for generating a specified path. In addition, the 3-DOF C
APA, Harvard, Vancouver, ISO, and other styles
7

Martins, Bruna Nery, Allane C. C. Rodrigues, Arsênio P. V. Neto, Ademir J. Camargo, and Heibbe C. B. de Oliveira. "Estudo dos efeitos da solvatação aquosa na norepinefrina usando Dinâmica Molecular de Car-Parrinello." In VIII Simpósio de Estrutura Eletrônica e Dinâmica Molecular. Universidade de Brasília, 2020. http://dx.doi.org/10.21826/viiiseedmol2020104.

Full text
Abstract:
Norepinephrine, synthesized from tyrosine, is a neurotransmitter of sympathetic post-ganglion neurons. Norepinephrine regulates many critical functions which include attention, memory, learning and cardiovascular functions. This neurotransmitter has several pharmacological uses, such as adrenergic stimulants, widely used in the treatment of hypertension, cardiac surgery and in myocardial infarction. It is extremely important to study the interaction between drugs and water molecules, for a better understanding of absorption, transport and biological action. Within this context, the Car-Parrine
APA, Harvard, Vancouver, ISO, and other styles
8

Hao, Guangbo, and Xianwen Kong. "Novel XY Compliant Parallel Manipulators for Large Displacement Translation With Enhanced Stiffness." In ASME 2010 International Design Engineering Technical Conferences and Computers and Information in Engineering Conference. ASMEDC, 2010. http://dx.doi.org/10.1115/detc2010-28141.

Full text
Abstract:
A novel XY compliant parallel manipulator (CPM) and a spatial double three-beam module both with distributed compliance are first proposed for large range of translation. Then, an improved XY CPM is proposed by combining the above XY CPM and a spatial double three-beam module in parallel. The normalized analytical models are further presented for the novel XY CPM, double three-beam module and improved XY CPM. It is shown that the improved XY CPM has the following merits: (1) large range of motion, constrained parasitic error motion, output-decoupling, maximal actuation isolation and minimal lo
APA, Harvard, Vancouver, ISO, and other styles
9

Yu, Jingjun, Zhenguo Li, Dengfeng Lu, Guanghua Zong, and Guangbo Hao. "Design and Analysis of New Large-Range XY Compliant Parallel Micromanipulators." In ASME 2014 International Design Engineering Technical Conferences and Computers and Information in Engineering Conference. American Society of Mechanical Engineers, 2014. http://dx.doi.org/10.1115/detc2014-34982.

Full text
Abstract:
The need for a compliant parallel micromanipulator (CPM) providing large motion range and high precision is increasing. Existing CPMs vary in constraint configurations and therefore it is necessary to verify/compare their characteristics. This paper compares three kinds of typical over-constrained CPMs, and derives their theoretical compliance matrix models pointing out constraint characteristics of the three kinematic configurations. Then the three CPMs are analyzed with FEA (finite element analysis), and results illustrate that the theoretical compliance matrix models are close to their FEA
APA, Harvard, Vancouver, ISO, and other styles
10

Zhu, Jiaxiang, Guangbo Hao, Shiyao Li, Shuwen Yu, and Xianwen Kong. "A Mirror-Symmetrical XY Compliant Parallel Manipulator With Improved Performances Without Increasing the Footprint." In ASME 2021 International Design Engineering Technical Conferences and Computers and Information in Engineering Conference. American Society of Mechanical Engineers, 2021. http://dx.doi.org/10.1115/detc2021-69032.

Full text
Abstract:
Abstract The design of XY compliant parallel manipulators (CPMs) remains challenging considering the tradeoff between the mirror-symmetry for better constrained undesired rotations and the small footprint, although a significant number of XY CPMs have been reported in extensive applications. This paper presents a new XY CPM using mirror-symmetry without increasing its footprint, mainly aiming to reduce the undesired parasitic rotations of input and output motion stages. The concept of higher degree of stiffness centre symmetry is deployed to tackle the parasitic rotations, leading to a multi-l
APA, Harvard, Vancouver, ISO, and other styles

Reports on the topic "CPMD"

1

Fenves, Steven J., Sebti Foufou, Conrad Bock, Rachuri Sudarsan, Nicolas Bouillon, and Ram D. Sriram. CPM 2:. National Institute of Standards and Technology, 2004. http://dx.doi.org/10.6028/nist.ir.7185.

Full text
APA, Harvard, Vancouver, ISO, and other styles
2

Maugham, Charlotte. Land governance and transparency livelihoods. CPD event: overview. Evidence on Demand, 2013. http://dx.doi.org/10.12774/eod_cr.nov2013b.maugham.

Full text
APA, Harvard, Vancouver, ISO, and other styles
3

Berges, B. P. J., S. C. V. Geelhoed, M. Scheidat, and J. Tougaard. Quantifying harbour porpoise foraging behaviour in CPOD data: identification, automatic detection and potential application. Wageningen Marine Research, 2019. http://dx.doi.org/10.18174/475270.

Full text
APA, Harvard, Vancouver, ISO, and other styles
4

Greer, T. Richard. Final Report Roberts Wesleyan College Geothermal Energy Project CPD No. 84.09. Office of Scientific and Technical Information (OSTI), 2016. http://dx.doi.org/10.2172/1240147.

Full text
APA, Harvard, Vancouver, ISO, and other styles
5

Elmaghraby, Salah E., and David J. Michael. Documentation of BIDNET: Project Bidding for CPM and PERT Activity Networks. Defense Technical Information Center, 1988. http://dx.doi.org/10.21236/ada198761.

Full text
APA, Harvard, Vancouver, ISO, and other styles
6

Wylie, Marilynn, and Glenn Green. On the Performance of Serially Concatenated CPM-OFDMA Schemes for Aeronautical Telemetry. Defense Technical Information Center, 2011. http://dx.doi.org/10.21236/ada543383.

Full text
APA, Harvard, Vancouver, ISO, and other styles
7

Allen, J. C., and B. E. Wahlen. Multi-h CPM Synchronization in Military Channels Phase 2: A Simulation Framework. Defense Technical Information Center, 2003. http://dx.doi.org/10.21236/ada419930.

Full text
APA, Harvard, Vancouver, ISO, and other styles
8

Prather, Craig S. CPM Scheduling: The Contracting Officers' Guide for Risk Minimization and Claims Analysis. Defense Technical Information Center, 1998. http://dx.doi.org/10.21236/ada350969.

Full text
APA, Harvard, Vancouver, ISO, and other styles
9

Dutta-Roy, Kunal, Vernon Mallu, and David Shaw. PR-426-123723-R01 Pipeline Variable Uncertainties and Their Effects on Leak Detection Sensitivity. Pipeline Research Council International, Inc. (PRCI), 2018. http://dx.doi.org/10.55274/r0011502.

Full text
Abstract:
This document is a revision of industry standard procedures for the assessment of uncertainties in software-based leak detection systems. This document describes procedures for predicting uncertainties in the detection of leaks in pipelines using computational methods based upon physical hydraulic state measurements. This class of pipeline leak detection methods is commonly called Computational Pipeline Monitoring (CPM). The API1149 process and software-based leak detection systems (LDS), often loosely referred to as Computational Pipeline Monitoring (CPM) rely upon field measurement and instr
APA, Harvard, Vancouver, ISO, and other styles
10

Chelluri, Bhanumathi, and Edward Knoth. High Performance PrFeB Permanent Magnets through Novel Pulse Alignment and Compaction Method for Cryogenic Permanent Magnet Undulators (CPMU). Office of Scientific and Technical Information (OSTI), 2012. http://dx.doi.org/10.2172/1428153.

Full text
APA, Harvard, Vancouver, ISO, and other styles
We offer discounts on all premium plans for authors whose works are included in thematic literature selections. Contact us to get a unique promo code!