Pharao: pharmacophore alignment and optimization.

scientific article published on 11 April 2008

Pharao: pharmacophore alignment and optimization. is …
instance of (P31):
scholarly articleQ13442814

External links are
P356DOI10.1016/J.JMGM.2008.04.003
P698PubMed publication ID18485770

P50authorGert ThijsQ51878942
Hans De WinterQ51878943
P2093author name stringJonatan Taminau
P433issue2
P304page(s)161-169
P577publication date2008-04-11
P1433published inJournal of Molecular Graphics & ModellingQ3186928
P1476titlePharao: pharmacophore alignment and optimization.
P478volume27

Reverse relations

cites work (P2860)
Q410187163D Chemical Similarity Networks for Structure-Based Target Prediction and Scaffold Hopping
Q500294983D-e-Chem: Structural Cheminformatics Workflows for Computer-Aided Drug Discovery.
Q39865935A rotation-translation invariant molecular descriptor of partial charges and its use in ligand-based virtual screening
Q57307431Chemical space of Escherichia coli dihydrofolate reductase inhibitors: New approaches for discovering novel drugs for old bugs
Q36554718Choosing the Optimal Rigid Receptor for Docking and Scoring in the CSAR 2013/2014 Experiment
Q35589799Computational and biophysical approaches to protein-protein interaction inhibition of Plasmodium falciparum AMA1/RON2 complex.
Q42011227Development and validation of an improved algorithm for overlaying flexible molecules
Q42680012Discovery by organism based high-throughput screening of new multi-stage compounds affecting Schistosoma mansoni viability, egg formation and production.
Q57162600G-quadruplex virtual drug screening: A review
Q41692303Implementing the "Best Template Searching" tool into Adenosiland platform
Q51092695Insight into the structural requirements of pyrimidine-based phosphodiesterase 10A (PDE10A) inhibitors by multiple validated 3D QSAR approaches.
Q35076245LIGSIFT: an open-source tool for ligand structural alignment and virtual screening
Q52692628LS-align: an atom-level, flexible ligand structural alignment algorithm for high-throughput virtual screening.
Q38896131Ligand-based virtual screening under partial shape constraints
Q28598346Open source molecular modeling
Q51544926Open3DALIGN: an open-source software aimed at unsupervised ligand alignment.
Q36087114Pharmacophores in Drug Research.
Q30043178Plasmodium falciparum CTP:phosphocholine cytidylyltransferase possesses two functional catalytic domains and is inhibited by a CDP-choline analog selected from a virtual screening
Q30377334PoLi: A Virtual Screening Pipeline Based on Template Pocket and Ligand Similarity.
Q46972435Quantitative structure-property relationship modeling of Grätzel solar cell dyes.
Q58041489SPOT-Ligand: Fast and effective structure-based virtual screening by binding homology search according to ligand and receptor similarity
Q28745255The power metric: a new statistically robust enrichment-type metric for virtual screening applications with early recovery capability
Q42418633Training a scoring function for the alignment of small molecules
Q39449589mRAISE: an alternative algorithmic approach to ligand-based virtual screening

Search more.