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This detailed book collects modern and established computer-based
methods aimed at addressing the drug discovery challenge from
disparate perspectives by exploiting information on ligand-protein
recognition. Beginning with methods that allow for the exploration
of specific areas of chemical space and the designing of virtual
libraries, the volume continues with sections on methods based on
docking, quantitative models, and molecular dynamics simulations,
which are employed for ligand discovery or development, as well as
methods exploiting an ensemble of protein structures for the
identification of potential protein targets. Written for the highly
successful Methods in Molecular Biology series, chapters include
introductions to their respective topics, lists of the necessary
materials, step-by-step, readily reproducible laboratory protocols,
and tips on troubleshooting and avoiding known pitfalls.
Authoritative and cutting-edge, Protein-Ligand Interactions and
Drug Design provides detailed practical procedures of solid
computer-aided drug design methodologies employed to rationalize
and optimize protein-ligand interactions, for experienced
researchers and novices alike.
This detailed book collects modern and established computer-based
methods aimed at addressing the drug discovery challenge from
disparate perspectives by exploiting information on ligand-protein
recognition. Beginning with methods that allow for the exploration
of specific areas of chemical space and the designing of virtual
libraries, the volume continues with sections on methods based on
docking, quantitative models, and molecular dynamics simulations,
which are employed for ligand discovery or development, as well as
methods exploiting an ensemble of protein structures for the
identification of potential protein targets. Written for the highly
successful Methods in Molecular Biology series, chapters include
introductions to their respective topics, lists of the necessary
materials, step-by-step, readily reproducible laboratory protocols,
and tips on troubleshooting and avoiding known pitfalls.
Authoritative and cutting-edge, Protein-Ligand Interactions and
Drug Design provides detailed practical procedures of solid
computer-aided drug design methodologies employed to rationalize
and optimize protein-ligand interactions, for experienced
researchers and novices alike.
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Catan
(16)
R1,150
R889
Discovery Miles 8 890
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