Volume 3, Issue 1

Perspectives in Drug Discovery and Design is now archived and no longer receiving submissions with this publisher. All articles published in the journal during its time with Springer will remain fully searchable through our websites.

Search all Perspectives in Drug Discovery and Design articles

December 1995

11 articles in this issue

Preface
Klaus Müller
EditorialNotes Pages: v - vii
Automated chemical hypothesis generation and database searching with Catalyst^®
Peter W. Sprague
OriginalPaper Pages: 1 - 20
Site-directed structure generation by fragment-joining
Hans-Joachim Böhm
OriginalPaper Pages: 21 - 33
SPROUT, HIPPO and CAESA: Tools for de novo structure generation and estimation of synthetic accessibility
Valerie J. Gillet
Glenn Myatt
A. Peter Johnson
OriginalPaper Pages: 34 - 50
Computational combinatorial chemistry for de novo ligand design: Review and assessment
Amedeo Caflisch
Martin Karplus
OriginalPaper Pages: 51 - 84
Toward a more efficient handling of conformational flexibility in computer-assisted modelling of drug molecules
Gerhard Klebe
OriginalPaper Pages: 85 - 105
Applications of free energy derivatives to analog design
Yuan-Ping Pang
Peter A. Kollman
OriginalPaper Pages: 106 - 122
Free energies of hydration for organic molecules from Monte Carlo simulations
William L. Jorgensen
Julian Tirado-Rives
OriginalPaper Pages: 123 - 138
Accomplishments and challenges in integrating software for computer-aided ligand design in drug discovery
Yvonne Connolly Martin
OriginalPaper Pages: 139 - 150
NMR for structural studies in drug discovery
Martin Billeter
OriginalPaper Pages: 151 - 167
Backward binding and other structural surprises
Edgar F. Meyer
Istvan Botos
Dachuan Zhang
OriginalPaper Pages: 168 - 195

Volume 3, Issue 1

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