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Large organisms

The first energy derivative is called the gradient g and is the negative of the force F (with components along the a center denoted Fa) experienced by the atomic centers F = -g. These forces, as discussed in Chapter 16, can be used to carry out classical trajectory simulations of molecular collisions or other motions of large organic and biological molecules for which a quantum treatment of the nuclear motion is prohibitive. [Pg.513]

The most severe limitation of ah initio methods is the limited size of the molecule that can be modeled on even the largest computers. Semiempirical calculations can be used for large organic molecules, but are also too computation-intensive for most biomolecular systems. If a molecule is so big that a semiempirical treatment cannot be used elfectively, it is still possible to model its behavior avoiding quantum mechanics totally by using molecular mechanics. [Pg.49]

The HyperChem program from Hypercube Inc. and UniChem from Oxford Molecular can be used as graphic interfaces to Q-Chem. At the time we conducted our tests, it was not yet available on all the platforms listed as being supported. The current version is well designed for ground- and excited-state calculations on small or large organic molecules. [Pg.340]

Amberlite IRA-402 1.3 1.07 Lower cross-linkage than IRA-400 better diffusion rate with large organic molecules. [Pg.1110]

Amberlite IRA-68 1.6 1.06 Acrylic-DVB with unusually high capacity for large organic molecules. [Pg.1111]

The friction material industry consists of several large organizations having many divisions, as well as more than 60 smaller companies. The primary supphers approximate worldwide market share, trade names, and joint ventures/Hcensees (jv/l) as of mid-1991 were AUied-Signal (21%) Bendix,... [Pg.276]

Chloroformates are reactive intermediates that combine acid chloride and ester functions. They undergo many reactions similar to those of acid chlorides however, the rates are usually slower (4—8). Those containing smaller organic (hydrocarbon) substituents react faster than those containing large organic (hydrocarbon) substituents (3). Reactions of chloroformates and other acid chlorides proceed faster with better yields when alkaU hydroxides or tertiary amines are present to react with the HCl as it forms. These bases act as stoichiometric acid acceptors rather than as tme catalysts. [Pg.38]

The above analysis indicates that the high concentrations of sulfur-containing deposits and corrosion products were caused by the influence of large organisms. Bacterial contributions to corrosion and associated fouling were minimal. [Pg.156]

Arable farmers in the UK rarely grow more than one crop in a year, but horticulturalists may grow two or more crops in a year on the same soil, so the question of crop sequences is more intense for them, particularly as Brassica vegetables, such as cabbages and brussel sprouts, can leave large organic as well as mineral nitrogen residues. [Pg.15]

To help the reader keep abreast of these advances we present a list of useful WWW sites in this appendix. Realistically, this list should be updated on a daily basis as many of the tools offered on the Internet are made available not only by large organizations and research groups but also by individual researchers. The goal, therefore, has not been to provide a nearly complete guide to the WWW but rather to provide material representative of the tools useful to researchers in the fields of biochemistry and biophysics. [Pg.497]

If you have one quality system, the roles of management representative and quality director become difficult to separate and can cause a conflict of interest unless the management representative is the CEO. In large organizations with multiple sites, each with separate ISO 9000 registrations, a more appropriate solution is to have a management representative for each site and one quality director for the whole organization. [Pg.131]

These deposits would result in carbonate rock (e.g., limestone). A third source rock possibility would be evaporite rocks (e.g., salt, gypsum, anhydrite), which often contain large organic concentrations when originally deposited [26-29]. [Pg.244]

Most large organizations, particularly in central and local government, have set procedures in the form of standing orders, and this area is usually of most interest to internal and external auditors. The object of inviting competitive bids is to obtain the lowest price for the job, based on a fair method, which enables every bidder to bid for the same thing. [Pg.89]

Bids should be returned in endorsed envelopes so that it can be seen that a bid for a named project is enclosed, but should not disclose whose bid it is. In large organizations it is normal for bids to be returned by a certain date and time, to a certain place, which is usually either a legal or an administrative department. [Pg.90]

Within a large organization there may well be sufficient continuous work to keep a small team of... [Pg.460]

Most of the impurities in the FCC feed exist as components of large organic molecules. The most common contaminants are ... [Pg.54]


See other pages where Large organisms is mentioned: [Pg.411]    [Pg.573]    [Pg.574]    [Pg.120]    [Pg.1109]    [Pg.273]    [Pg.392]    [Pg.221]    [Pg.2228]    [Pg.127]    [Pg.140]    [Pg.142]    [Pg.146]    [Pg.156]    [Pg.247]    [Pg.410]    [Pg.244]    [Pg.418]    [Pg.9]    [Pg.104]    [Pg.229]    [Pg.460]    [Pg.460]    [Pg.1027]    [Pg.1173]    [Pg.1215]    [Pg.424]    [Pg.74]    [Pg.397]    [Pg.12]    [Pg.163]    [Pg.168]    [Pg.107]   
See also in sourсe #XX -- [ Pg.5 ]




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