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D P Reynolds

Publications and source records attributed to D P Reynolds.

7 recordsLinked to original sources
PubMed2001

Rapid method for the estimation of octanol/water partition coefficient (log P(oct)) from gradient RP-HPLC retention and a hydrogen bond acidity term (zetaalpha(2)(H)).

We propose a rapid method for the measurement of octanol/water partition coefficients (log P(oct)) via fast gradient reversed phase retention and the calculation of the hydrogen bond acidity of the compounds. The cycle time of the generic gradient HPLC method is 5 minutes. The general solvation equation obtained for the log Poct values and the fast gradient Chromatographic Hydrophobicity Indices with acetonitrile (CHI(ACN)) and methanol

Chemical Phenomena↗
PubMed2000

Rapid-gradient HPLC method for measuring drug interactions with immobilized artificial membrane: comparison with other lipophilicity measures.

A fast-gradient high-performance liquid chromatographic (HPLC) method has been suggested to characterize the interactions of drugs with an immobilized artificial membrane (IAM). With a set of standards, the gradient retention times can be converted to Chromatographic Hydrophobicity Index values referring to IAM chromatography (CHI(IAM)) that approximates an acetonitrile concentration with which the equal distribution of compound can be achieved between the mobile phase and IAM. The CHI(IAM) values are more suitable for interlaboratory comparison and for high throughput screening of new molecular entities than the log k(IAM) values (isocratic retention factor on IAM). The fast-gradient method has been validated against the isocratic log k(IAM) values using the linear free energy relationship solvation equations based on the data from 48 compounds. The compound set was selected to provide a wide range and the least cross-correlation between the molecular descriptors in the solvation equation: (2) where SP is a solute property (e.g., logarithm of partition coefficients, reversed-phase (RP)-HPLC retention parameters, such as log k, log k(w), etc.) and the explanatory variables are solute descriptors as follows: R(2) is an excess molar refraction that can be obtained from the measured refractive index of a compound, pi(2)(H) is the solute dipolarity/polarizability, summation operatoralpha(2)(H) and summation operatorbeta(2)(0) are the solute overall or effective hydrogen-bond acidity and basicity, respectively, and V(x) is the McGowan characteristic volume (in cm(3)/100 mol) that can be calculated for any solute simply from molecular structure using a table of atomic constants. It was found that the relative constants of the solvation equation were very similar for the CHI(IAM) and for the log k(IAM). The IAM lipophilicity scale was quite similar to the octanol/water lipophilicity scale for neutral compounds. The effect of charge on the interaction with IAM was studied by varying the mobile phase pH.

Chromatography, High Pressure Liquid↗
PubMed1992

Interface load analysis for computer-aided design of below-knee prosthetic sockets.

A finite-element analysis is made for the compression of soft tissues of the residual lower limb contained in a prosthetic socket. The analysis is relevant to static loading during stance in a patellar-tendon-bearing, below-knee design of socket. Values of Young's modulus are obtained experimentally for use in the model. One of the main objectives is to study the sensitivity of the loading to these values and also to other assumed conditions. Using direct pressure at the limb/socket interface and vertical stiffness as indicators, changes in material properties, socket alignment and socket rectification are investigated; assumptions about the frictional characteristic at the interface are seen to be critical in determination of load distribution. This type of analysis may provide the next stage of refinement for computer-aided socket design systems.

Artificial Limbs↗
PubMed1986

Foot pressure measurement: a review of clinical findings.

In this review, a description of what is known about plantar pressure distribution in standing and in gait is followed by sections on clinical findings. Two major clinical areas are treated extensively, namely the diabetic foot and the foot in rheumatoid arthritis. Other applications, including the assessment of surgical procedures for orthopaedic corrections are also included. A large variety of different techniques for foot pressure measurement have been used; interpretation of the results has to be made on the basis of a firm understanding of the technique employed. Often, quantitative results from different pieces of apparatus are difficult to compare, indicating a need for accurate calibration and a standardized presentation. An up-to-date summary of pressure measurement systems reported over the past five years is included.

Arthritis, Rheumatoid↗