The Resource In silico medicinal chemistry : computational methods to support drug design, Nathan Brown

In silico medicinal chemistry : computational methods to support drug design, Nathan Brown

Label
In silico medicinal chemistry : computational methods to support drug design
Title
In silico medicinal chemistry
Title remainder
computational methods to support drug design
Statement of responsibility
Nathan Brown
Creator
Contributor
Author
Subject
Language
eng
Summary
Covering computational tools in drug design using techniques from chemoinformatics, molecular modelling and computational chemistry, this book explores these methodologies and applications of in silico medicinal chemistry. The first part of the book covers molecular representation methods in computing in terms of chemical structure, together with guides on common structure file formats. The second part examines commonly used classes of molecular descriptors. The third part provides a guide to statistical learning methods using chemical structure data, covering topics such as similarity searching, clustering and diversity selection, virtual library design, ligand docking and de novo design. The final part of the book summarises the application of methods to the different stages of drug discovery, from target ID, through hit finding and hit-to-lead, to lead optimisation. This book is a practical introduction to the subject for researchers new to the fields of chemoinformatics, molecular modelling and computational chemistry
Member of
Cataloging source
UKRSC
Dewey number
615.1/900285
Index
index present
LC call number
RS418
Literary form
non fiction
Nature of contents
dictionaries
Series statement
RSC theoretical and computational chemistry series
Series volume
8
Label
In silico medicinal chemistry : computational methods to support drug design, Nathan Brown
Publication
Copyright
Note
Includes index
Antecedent source
unknown
http://library.link/vocab/branchCode
  • net
Carrier category
online resource
Carrier category code
cr
Carrier MARC source
rdacarrier
Color
multicolored
Content category
text
Content type code
txt
Content type MARC source
rdacontent
Control code
ocn929953680
Dimensions
unknown
Extent
1 online resource
File format
unknown
Form of item
online
Isbn
9781782621638
Level of compression
unknown
Media category
computer
Media MARC source
rdamedia
Media type code
c
http://library.link/vocab/ext/overdrive/overdriveId
3905:3783
Quality assurance targets
not applicable
http://library.link/vocab/recordID
.b33778917
Reformatting quality
unknown
Sound
unknown sound
Specific material designation
remote
System control number
  • (OCoLC)929953680
  • rsc1782622608

Library Locations

    • Deakin University Library - Geelong Waurn Ponds CampusBorrow it
      75 Pigdons Road, Waurn Ponds, Victoria, 3216, AU
      -38.195656 144.304955
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