Docking and scoring--theoretically easy, practically impossible?
about
Systematic exploitation of multiple receptor conformations for virtual ligand screeningAutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibilityMethods of protein structure comparison.Novel mycosin protease MycP₁ inhibitors identified by virtual screening and 4D fingerprintsChimeric design, synthesis, and biological assays of a new nonpeptide insulin-mimetic vanadium compound to inhibit protein tyrosine phosphatase 1BVirtual screening of chemical libraries for drug discovery.Virtual Screening with AutoDock: Theory and Practice.Molecular docking: a powerful approach for structure-based drug discoveryStatistical potential for modeling and ranking of protein-ligand interactionsModeling Protein-Ligand Binding by Mining Minima.Predicting new indications for approved drugs using a proteochemometric method.Profiling lipid-protein interactions using nonquenched fluorescent liposomal nanovesicles and proteome microarraysComputational molecular modeling for evaluating the toxicity of environmental chemicals: prioritizing bioassay requirements.MedusaScore: an accurate force field-based scoring function for virtual drug screening.Ligand and structure-based methodologies for the prediction of the activity of G protein-coupled receptor ligandsRapid activity prediction of HIV-1 integrase inhibitors: harnessing docking energetic components for empirical scoring by chemometric and artificial neural network approaches.Identification of the quinolinedione inhibitor binding site in Cdc25 phosphatase B through docking and molecular dynamics simulations.A comparative study of family-specific protein-ligand complex affinity prediction based on random forest approach.Antidiabetic Bis-Maltolato-OxoVanadium(IV): conversion of inactive trans- to bioactive cis-BMOV for possible binding to target PTP-1B.Covalent docking of selected boron-based serine beta-lactamase inhibitors
P2860
Q28478200-EE325BD7-59AE-46E2-B2DA-738EACB87478Q29547658-A79861DE-4BB9-486B-98DC-F6FC05D88164Q30412884-2F719317-E46B-4094-ADB0-105B1FDAA504Q33567085-60996B3B-868E-4BAB-B6FF-ABC0D58F8F96Q34170125-4CD2C4C9-362C-46E0-8382-9AB45A6BD39DQ34626368-C7AA20E0-77C4-418F-8B3E-2EC38F44E4BAQ34867648-677DA39F-60AD-4165-B1D7-4CD47F491DBCQ35150471-0AFFD8DF-FFC6-43A4-BD95-0D8FAEB12518Q35635713-2B12B101-382E-4948-B3A1-FE97E01604A6Q35987132-C083FBAA-EC38-436D-9959-79D186730C21Q36165369-42F5D7CB-4FDD-4292-B359-C16AACB0B1FFQ36386960-4952811B-89FD-4876-A189-0D4CA1D73E10Q36633020-76C66269-296E-4AB2-AD5E-57C93A620534Q37149411-3A9392D8-D6DB-401B-AA68-9F4FB60631E4Q37464148-032727AA-2EEA-4072-9FAF-458984CABFADQ39675574-73C82142-205D-455F-810B-F1C1B05B058DQ41921115-F711FDAB-D606-4466-96EF-5641E5090BF8Q42176495-308257B2-A0D9-49BF-85CB-E5AE40A149EBQ42582786-552A658F-CFC6-4A8F-A5DE-5A7BC035278AQ57794478-12B510C1-C29E-4F19-AA3E-0BC707C4DFBA
P2860
Docking and scoring--theoretically easy, practically impossible?
description
2006 nî lūn-bûn
@nan
2006年の論文
@ja
2006年論文
@yue
2006年論文
@zh-hant
2006年論文
@zh-hk
2006年論文
@zh-mo
2006年論文
@zh-tw
2006年论文
@wuu
2006年论文
@zh
2006年论文
@zh-cn
name
Docking and scoring--theoretically easy, practically impossible?
@ast
Docking and scoring--theoretically easy, practically impossible?
@en
type
label
Docking and scoring--theoretically easy, practically impossible?
@ast
Docking and scoring--theoretically easy, practically impossible?
@en
prefLabel
Docking and scoring--theoretically easy, practically impossible?
@ast
Docking and scoring--theoretically easy, practically impossible?
@en
P1476
Docking and scoring--theoretically easy, practically impossible?
@en
P2093
P304
P356
10.2174/092986706778521797
P577
2006-01-01T00:00:00Z