| BIDS
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Bath Information and Data Services - providing bibliographic
data and full text services for higher education and research.
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| PDB
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Protein Data Bank mirror site at Cambridge
Crystallographic Data Centre. An archive of experimentally
determined three-dimensional structures of biological macromolecules, serving a global community of researchers, educators, and students
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MD code
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programs from "Computer Simulations of Liquids", by M. P.
Allen and D. J. Tildesley (Clarendon Press, Oxford, 1987
(hardback), 1989 (paperback))
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| RSC
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The Royal Society of Chemistry is the Learned Society for
chemistry and the Professional Body for chemists in the UK with 46,000 members
worldwide.
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PubMed
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Produced by the National Librarary of Medicine in the USA,
PubMed is NLM's search service to access the 9 million citations in MEDLINE and Pre-MEDLINE (with links to participating on-line journals), and other related databases.
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| BioMed Net
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The World Wide Club for the Biological and Medical Community
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| CSD
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Home pages of the Cambridge Crystallographic Data Centre. The
CCDC builds and maintains the Cambridge Structural Database (CSD), the largest searchable database of experimentally determined crystal structures.
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| SWISS-PROT
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The World Wide Web (WWW) molecular biology server of the
Geneva University Hospital and the University of Geneva. This server is dedicated to the analysis of protein and nucleic acid sequences.
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| MC FTP Archive
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An FTP site based at Manchester Computing.
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| CCP
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The Collaborative Computational Projects (CCPs), assist
universities in developing, maintaining and distributing computer programs and promoting the best computational
methods.
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UMIST Library
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search engine for the UMIST library catalogue
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| EPCC
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Edinburgh Parallel Computing Centre, home to the national
service Cray T3D and T3E facilities.
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Accelrys
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a software company that provides
scientific software, research services, and information technology to the pharmaceutical, chemical, biotechnology, and academic markets.
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MGMS
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The Molecular Graphics and Modelling Society home pages.
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CCL
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Home pages of the Computational Chemistry List, an independent
electronic discussion forum for chemistry researchers and educators from
around the world.
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| ACSWeb
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Homepages for the American Chemical Society
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ChemWeb
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The World Wide Club for the Chemical Community
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| latex
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The text formatting and typesetting package
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| gnuplot
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manual for gnuplot, an interactive plotting program
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| molden
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MOLDEN is an excellent package for displaying molecular structures and densities, tuned to the GAMESS-UK and GAUSSIAN packages.
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| rasmol
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RasMol is a molecular graphics program intended for the
visualisation of proteins, nucleic acids and small molecules.
The program is aimed at display, teaching and generation of
publication quality images.
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| molscript
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MolScript is a program for creating molecular graphics in the
form of PostScript
plot files. Can also produce input for the 'render' program, to give
photorealistic images.
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| html
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reference manual for the hypertext markup language used in web
page design.
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| xmgr
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xmgr (ACE/gr) is an XY plotting tool for workstations or X-terminals
using X.
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| raster3d
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The Raster3D molecular graphics package consists of a core program (render) and a number of ancillary programs which produce input files for rendering from Brookhaven PDB files of atomic coordinates. Raster3D can also render images composed using version 1.4 of Molscript
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| unix:
|
a two page (i.e. very short) summary and introduction to unix and the vi editor.
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| C
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This series contains a set of tutorials that help you to learn about the C programming language. These tutorials start with the assumption that you know a procedural language like Pascal or Fortran already, and simply want to map that knowledge to C.
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| gimp
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GIMP is an acronym for GNU Image Manipulation Program.
It is a freely distributed piece of software suitable for such tasks as photo retouching, image composition and image authoring. It is an extremely capable piece of software with many capabilities. It can be used as a simple paint program, a expert quality photo retouching program, an online batch processing system, a mass production image renderer, a image format converter, etc. GIMP is extremely expandedable and extensible. It is designed to be augmented with plugins and extensions to do just about anything. The advanced scripting interface allows everything from the simplest task to the most complex image manipulation procedures to be easily scripted.
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| amber
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AMBER refers to two things: a molecular mechanical force field
for the simulation of biomolecules (which is in general use in a variety of simulation programs); and a package of molecular simulation programs which includes source code and demos.
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| gopenmol
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gOpenMol can be used for the analysis and display of molecular dynamics trajectories and the display of molecular orbitals, electron densities and electrostatic potentials from programs like Gaussian.
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| charmm
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CHARMM: A Program for Macromolecular Energy, Minimization, and Dynamics Calculations.
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| macromodel
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An Integrated Software System for Modeling Organic and
Bioorganic Molecules Using Molecular Mechanics.
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| chemfinder
|
The chemfinder webserver is a chemical database, working from
a single master list of chemical compounds, allowing you to find the
information you want faster.
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| numerical
recipes
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A complete copy of Numerical Recipes in Fortran, The Art of
Scientific Computing Second Edition, online
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