The problems of X-ray crystal structure determination require some type of automatic computing machinery. An evaluation of these problems has lead to the conclusions that a parallel channel relay digital computer operating in conjunction with the standard I. B. M. units will meet the calculation needs of a structure determination and greatly shorten the time and labor involved. A brief description of a relay computer designed to meet these needs has been given. The computer will be able to perform all of the calculations required with the exception of the Patterson and electron density calculations. The latter may be carried out efficiently on standard I. B. M. units
A fundamental computational methodology was investigated to extract quantitative local structure inf...
The relationship between the structure and the properties of a drug or material is a key concept of ...
A hybrid computer for structure factor calculations in X-ray crystallography is described. The compu...
The problem of x-ray crystal structure determination require some type of automatic computing machin...
A method is described whereby the rapid calculation of the structure factors of X-ray crystallograph...
The application of punched cards and electrical accounting machines (of the International Business M...
The phase problem of X-ray crystallography is stated, some of the methods available for its solution...
X-ray crystallography is the natural choice for macromolecular structure determination by virtue of ...
X-ray structural analysis might be regarded as a method of visualizing molecules as they appear in t...
tural biologists to perform state-of-the-art crystallography diraction experiments with high-intensi...
X-ray crystallography provides us with the most accurate picture we can get of atomic and molecular ...
The structures of four compounds representing each of the organic (natural product), inorganic and o...
The thesis is divided into three main parts; the first is devoted to a brief review of the theory an...
In an X-ray crystallographic experiment, intensities and directions of X-rays scattered by electrons...
The work described within this thesis is mainly concerned with the solution and refinement of the mo...
A fundamental computational methodology was investigated to extract quantitative local structure inf...
The relationship between the structure and the properties of a drug or material is a key concept of ...
A hybrid computer for structure factor calculations in X-ray crystallography is described. The compu...
The problem of x-ray crystal structure determination require some type of automatic computing machin...
A method is described whereby the rapid calculation of the structure factors of X-ray crystallograph...
The application of punched cards and electrical accounting machines (of the International Business M...
The phase problem of X-ray crystallography is stated, some of the methods available for its solution...
X-ray crystallography is the natural choice for macromolecular structure determination by virtue of ...
X-ray structural analysis might be regarded as a method of visualizing molecules as they appear in t...
tural biologists to perform state-of-the-art crystallography diraction experiments with high-intensi...
X-ray crystallography provides us with the most accurate picture we can get of atomic and molecular ...
The structures of four compounds representing each of the organic (natural product), inorganic and o...
The thesis is divided into three main parts; the first is devoted to a brief review of the theory an...
In an X-ray crystallographic experiment, intensities and directions of X-rays scattered by electrons...
The work described within this thesis is mainly concerned with the solution and refinement of the mo...
A fundamental computational methodology was investigated to extract quantitative local structure inf...
The relationship between the structure and the properties of a drug or material is a key concept of ...
A hybrid computer for structure factor calculations in X-ray crystallography is described. The compu...