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Computational Design

This technique for finding a weighted average is used for ideal gas properties and quantum mechanical systems with quantized energy levels. It is not a convenient way to design computer simulations for real gas or condensed-phase... [Pg.13]

As illustrated in Figure 4, the model is created on a platform submerged in a bath that is mounted on a turntable and contains a suitable monomer including a photoinitiator responsive to a laser line. The laser is modulated by the design computer and scaimed radially while the turntable rotates to write... [Pg.392]

Type of Equipment Design " Computer Checking Total M-H Type of Equipment Design Computer Checking Total M-H ... [Pg.38]

More recently, the Southern Gas Association s Gas Machinery Research Council and Pipeline and Compressor Research Council cooperated with Southwest Research Institute to develop a software package that enhances reciprocating compressor operation. Several major American and foreign compressor manufacturers (and some other interested companies) have cooperated with Southwest Research Institute or developed their own proprietary pulsation-reduction design computer programs. [Pg.580]

At present, the API procedure is suggested by the authors as a reasonable approximadon technique but is not as thorough nor as specific as the design computer technique of Southwest Research Insdtute. ... [Pg.581]

ML McHugh, S Denger, D Cole. Data rich—information poor designing computer systems to support nursing s information needs. Kans Nurse 66 1-2, 1991. [Pg.790]

It is possible that metal removal is the result of a mechanical process, with solid (Zn3(As04)2 removed by filtration. To examine this, we modeled mineral stability using a custom designed computer program. [Pg.237]

Adjiman, C. S. I. P. Androulakis and C. A. Floudas. Global Optimization of MINLP Problems in Process Synthesis and Design. Comput Chem Eng 21 S445-450 (1997). [Pg.373]

Similar catalysts, although not designed computationally, have been used successfully for related addition reactions. In an approach to asymmetric... [Pg.86]

Molecular complexity, scales of, 24 31 Molecular computers, 27 61-62 24 60 Molecular design, computer-aided, 26 999 Molecular diffusion, 20 751. See also Diffusion... [Pg.595]

Algorithms as a Tool for Helix Design - Computational and Experimental Studies on Prion Protein Helix 1. [Pg.386]

Ng, K. M. (2004) MOPSD a framework linking business decision-making to product and process design, Computers and Chemical Engineering, 29, 51. [Pg.19]

A. W. Westerberg E. Subrahmanian, 2000, Product design, Computers Chemical Engineering, 24, 959-966. [Pg.471]

NMR spectroscopy derives its usefulness, in large measure, from its ability to detect constitutional symmetry. If constitutional symmetry is not taken into account in synthetic design computer programs, a redundancy of pathways may result. [Pg.9]

Mcmartin, C. and Bohacek, R.S. QXP powerful, rapid computer algorithms for structure-based drug design./. Comput.-Aided Mol. Des. 1997, 33, 333-344. [Pg.110]

Du, Q., Arteca, G. A., and Mezey, P. G. (1997) Heuristic lipophilicity potential for computer-aided rational drug design../. Comput.-Aided Mol. Design 11,503-515. [Pg.46]

Finance make projections of yearly cash flow on costs and revenues for your design, compute its net present value and internal rate of return. How do the proposed products rank in project return and security, and in corporate risk diversification ... [Pg.339]

In practical combustion systems, such as CO boilers, the flue gas experiences spatial and temporal variations. Constituent concentration, streamline residence time, and temperature are critical to determining an efficient process design. Computational fluid dynamics (CFD) modeling and chemical kinetic modeling are used to achieve accurate design assessments and NO, reduction predictions based on these parameters. The critical parameters affecting SNCR and eSNCR design are listed in Table 17.4. [Pg.324]

The similarity judgments are then analyzed by one of a number of specially designed computer programs that have been detailed by Schiffman, Reynolds and Young ( .) Some programs, such as INDSCAL, ALSCAL, and MULTISCALE, not only provide multidimensional arrangements of molecules based on their flavor similarity but provide quantitative measures that delineate the individual differences in response for each subject as well. The... [Pg.34]

Key words Fragment-based lead discovery, screening collection, library design, computational filtering, NMR screening... [Pg.219]

Key words Combinatorial library design, computer algorithms, product properties, multi-objective optimization. [Pg.337]

All of the values of this list can be established at least approximately by rapid shortcut methods. In some instances such values may be useful as final ones, but ordinarily they are for exploratory purposes or as a starting basis for a computer design. Computer design of fractionation is an iterative process which depends for rapid convergence on good starting estimates of the principal quantities. [Pg.395]


See other pages where Computational Design is mentioned: [Pg.63]    [Pg.54]    [Pg.312]    [Pg.15]    [Pg.80]    [Pg.610]    [Pg.38]    [Pg.150]    [Pg.269]    [Pg.25]    [Pg.567]    [Pg.73]    [Pg.413]    [Pg.315]    [Pg.69]    [Pg.656]    [Pg.230]    [Pg.112]    [Pg.114]    [Pg.197]    [Pg.36]    [Pg.100]    [Pg.103]    [Pg.460]    [Pg.163]    [Pg.31]    [Pg.311]   
See also in sourсe #XX -- [ Pg.120 ]




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COMPUTER-AIDED CATALYST DESIGN

Chemical Process Design: Computer-Aided Case Studies

Computational Chemistry, Molecular Complexity and Screening Set Design

Computational Modeling for the Rational MIP Design

Computational Tools for Hydrogen Bond Analysis and Design

Computational based design

Computational de novo design

Computational design parameters

Computational drug design

Computational library design

Computational library design clustering

Computational library design compound-based

Computational library design dissimilarity-based

Computational library design flexible

Computational library design genetic algorithms

Computational library design molecular descriptors

Computational library design partitioning

Computational library design pharmacophores

Computational library design selection methods

Computational library design simulated annealing

Computational materials design

Computational model, design principles

Computational model, design principles implementations

Computational protein design

Computational protein design degrees of freedom

Computational protein design energy function

Computational protein design examples

Computational protein design search methods

Computational protein design solvation and patterning

Computational protein design target structures

Computational techniques drug design

Computational tools computer-assisted drug design

Computational tools, process-based design

Computational topology design

Computed tomography design

Computer Aided Design drawings

Computer Aided Design flow-sheeting

Computer Aided Design heat exchangers

Computer Database Design Selection Procedure

Computer aided design

Computer aided design molding

Computer aided design systems

Computer aided design/manufacturing

Computer aided drag design

Computer aided molecular design

Computer assisted design

Computer design

Computer design

Computer design solvent systems

Computer in design

Computer modeling design basis

Computer program for the design

Computer programs laminate design

Computer simulations reactor design

Computer simulations tray design

Computer software experimental design

Computer software structural designs

Computer-Aided Design and

Computer-Assisted Molecular Design, CAMD

Computer-Assisted Synthesis Design

Computer-aided combinatorial library design

Computer-aided design and drafting

Computer-aided design and manufacturing

Computer-aided design application

Computer-aided design drafting

Computer-aided design function

Computer-aided design integrated modeling systems

Computer-aided design materials

Computer-aided design methods

Computer-aided design moulding

Computer-aided design pattern tools

Computer-aided design prototyping

Computer-aided design separations

Computer-aided design software

Computer-aided design techniques available

Computer-aided design, CAD

Computer-aided design, benefits

Computer-aided design/manufacture

Computer-aided drug design (CADD

Computer-aided electronic systems design

Computer-aided ligand design

Computer-aided ligand design (CALD

Computer-aided molecular design CAMD)

Computer-aided molecular design books

Computer-aided molecular design methods

Computer-aided molecular drug design

Computer-aided plant design

Computer-aided synthesis design

Computer-aided trial design

Computer-aided-designing

Computer-assisted alternative synthetic design

Computer-assisted design and

Computer-assisted design of reaction mechanisms

Computer-assisted design, CAD

Computer-assisted drug design

Computer-assisted drug design CADD)

Computer-assisted library design

Computer-assisted molecular design

Computer-assisted polymer design

Computer-based decision support system design

Computer-based experiment design

Computer-based green design tools

Conceptual process designs computational model

DESIGN, computer program

Design computation scheme

Design of distributed computer control systems

Design tools computer-based

Design with computers

Designer and computer

Drug design computer graphics

Drug design/discovery computational systems

Drugs, computer-aided design

Electronic computer-aided design

Engineering 1 Computer-aided Plant Design Software

Experimental design computation, interactions

Extraction computer aided design

Filtering Computational Library Design

Given structure, computer-aided molecular design

Inhibitors computer-aided design

Integrate modeling systems computer-aided design

Integrating Computational Materials Science Tools in Form and Formulation Design

Journal of Computer-Aided Molecular Design

Lead compounds computer-assisted drug design

Library Design via Computational Tools

Library design, computational aspects

Modeling computer-aided trial design

Modeling using computer-aided molecular design

Molecularly imprinted polymers computational design

Organic chemistry computer-aided design

PBSA Applied to Computer-Assisted Ligand Design

Plant design computers

Process design computer-assisted

Process design computers

Process design numerical computational methods

Proteins computational design approaches

Reactor design, computational algorithm

Second-generation computer-assisted inhibitor design method

Statistical computational assisted design

Substrate computer-aided design

Successes of Computer-Assisted Molecular Design

Summary of Computational Chemistry Techniques Applied to Peptide Mimetic Design

Symbolic computation engines process design

Technology computer-aided design

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