New method for rapid characterization of molecular shapes: applications in drug design

scientific article published on 01 January 1993

New method for rapid characterization of molecular shapes: applications in drug design is …
instance of (P31):
scholarly articleQ13442814

External links are
P8978DBLP publication IDjournals/jcisd/NilakantanBV93
P356DOI10.1021/CI00011A012
P698PubMed publication ID8440755

P2093author name stringNilakantan R
Venkataraghavan R
Bauman N
P433issue1
P304page(s)79-85
P577publication date1993-01-01
P1433published inJournal of Chemical Information and Computer SciencesQ104614957
P1476titleNew method for rapid characterization of molecular shapes: applications in drug design
P478volume33

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cites work (P2860)
Q342680653DMolNavi: a web-based retrieval and navigation tool for flexible molecular shape comparison
Q56700832Advances in the Development of Shape Similarity Methods and Their Application in Drug Discovery
Q28090770Chemical Similarity Searching
Q34364227Docking and scoring in virtual screening for drug discovery: methods and applications
Q51647018Feature trees: a new molecular similarity measure based on tree matching.
Q39554568Forecasting CYP2D6 and CYP3A4 Risk with a Global/Local Fusion Model of CYP450 Inhibition
Q33451022IDSS: deformation invariant signatures for molecular shape comparison
Q45994451Investigating the extension of pairwise distance pharmacophore measures to triplet-based descriptors.
Q42616113Layers: A molecular surface peeling algorithm and its applications to analyze protein structures
Q81437644Measuring CAMD technique performance: a virtual screening case study in the design of validation experiments
Q46652883New molecular shape descriptors: application in database screening
Q33444342Three dimensional shape comparison of flexible proteins using the local-diameter descriptor
Q73082193Use of recursive partitioning in the sequential screening of G-protein-coupled receptors

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