[PDF] Supercomputers in Chemistry Peter Lykos and Isaiah Shavitt (Eds.)

Content: The use of vector processors in quantum chemistry : experience in the United Kingdom / Martyn F. Guest and Stephen Wilson —
The academic computer resources in Japan and their contributions to theoretical chemistry / Katsunori Hijikata —
Supercomputer requirements for theoretical chemistry / Robert B. Walker, P. Jeffrey Hay, and Harold W. Galbraith —
The integration of chemical rate equations on a vector computer / Theodore R. Young and Marie C. Flanigan —
The use of a high-speed vector processor machine for chemical kinetic sensitivity analysis / David Edelson, Linda C. Kaufman, and Daniel D. Warner —
The effect of buoyancy on the thermal ignition of carbon monoxide / Walter W. Jones —
Supercomputers and the problem of organic synthesis / Malcolm Bersohn —
Computer methods of molecular structure elucidation from unknown mass spectra / In Ki Mun and Fred W. McLafferty —
The relative performances of several scientific computers for a liquid molecular dynamics simulation / D.M. Ceperley —
The need for supercomputers in time-dependent polymer simulations / Marvin Bishop, David Ceperley, H.L. Frisch, and M.H. Kalos —
Applications of large-scale computers and computer graphics : investigations of biological macromolecular structure, function, and evolution / Arthur M. Lesk and Karl D. Hardman —
Computer simulation of biomolecular systems / P. Dauber, Murray Goodman, A.T. Hagler, D. Osguthorpe, R. Sharon, and P. Stern —
A micro vector processor for molecular mechanics calculations / David N.J. White —
Programming language for supercomputers / Richard L. Lozes —
The advanced flexible processor, array architecture / Bruce Colton.