AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility - Wikidata - wikimedia - TriplyDB

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

http://www.wikidata.org/entity/Q29547658

about

Interactomic and pharmacological insights on human sirt-1 Bioinformatics in crosslinking chemistry of collagen with selective cross linkers 3D models of MBP, a biologically active metabolite of bisphenol A, in human estrogen receptor α and estrogen receptor β Genome of the human hookworm Necator americanus A quantitative chemical proteomics approach to profile the specific cellular targets of andrographolide, a promising anticancer agent that suppresses tumor metastasis BiP-mediated closing of the Sec61 channel limits Ca2+ leakage from the ER Structural and functional characterization of human peripheral nervous system myelin protein P2 Structure and function of human DnaJ homologue subfamily a member 1 (DNAJA1) and its relationship to pancreatic cancer Cooccupancy of the outer vestibule of voltage-gated sodium channels by micro-conotoxin KIIIA and saxitoxin or tetrodotoxin A flavin-dependent monooxygenase from Mycobacterium tuberculosis involved in cholesterol catabolism Genome scanning of Amazonian Plasmodium falciparum shows subtelomeric instability and clindamycin-resistant parasites Pharmacological inhibition of gut-derived serotonin synthesis is a potential bone anabolic treatment for osteoporosis α-Cyclodextrin dimer complexes of dopamine and levodopa derivatives to assess drug delivery to the central nervous system: ADME and molecular docking studies Computational Approaches to Toll-Like Receptor 4 Modulation Molecular docking as a popular tool in drug design, an in silico travel Drug Design for CNS Diseases: Polypharmacological Profiling of Compounds Using Cheminformatic, 3D-QSAR and Virtual Screening Methodologies Computational approaches in target identification and drug discovery Anti-malarial Drug Design by Targeting Apicoplasts: New Perspectives Principles and Overview of Sampling Methods for Modeling Macromolecular Structure and Dynamics Machine-learning scoring functions to improve structure-based binding affinity prediction and virtual screening Insights into Protein-Ligand Interactions: Mechanisms, Models, and Methods Cystoisospora suis - A Model of Mammalian Cystoisosporosis Surfing the Protein-Protein Interaction Surface Using Docking Methods: Application to the Design of PPI Inhibitors A review of metabolic and enzymatic engineering strategies for designing and optimizing performance of microbial cell factories Protein flexibility in docking and surface mapping Multiple Drug Transport Pathways through Human P-Glycoprotein.Identification of Chalcones as Fasciola hepatica Cathepsin L Inhibitors Using a Comprehensive Experimental and Computational Approach Molecular dynamic simulations reveal the structural determinants of Fatty Acid binding to oxy-myoglobin Discovery that theonellasterol a marine sponge sterol is a highly selective FXR antagonist that protects against liver injury in cholestasis Cardiac contractility structure-activity relationship and ligand-receptor interactions; the discovery of unique and novel molecular switches in myosuppressin signaling Structure, dynamics, and interaction of Mycobacterium tuberculosis (Mtb) DprE1 and DprE2 examined by molecular modeling, simulation, and electrostatic studies Effects of Small Molecule Calcium-Activated Chloride Channel Inhibitors on Structure and Function of Accessory Cholera Enterotoxin (Ace) of Vibrio cholerae Mechanism of p27 Unfolding for CDK2 Reactivation.Chemotherapeutic Potential of 2-[Piperidinoethoxyphenyl]-3-Phenyl-2H-Benzo(b)pyran in Estrogen Receptor- Negative Breast Cancer Cells: Action via Prevention of EGFR Activation and Combined Inhibition of PI-3-K/Akt/FOXO and MEK/Erk/AP-1 Pathways Interactions of L-3,5,3'-Triiodothyronine [corrected], Allopregnanolone, and Ivermectin with the GABAA Receptor: Evidence for Overlapping Intersubunit Binding Modes The evolutionary portrait of metazoan NAD salvage Binding interaction of a gamma-aminobutyric acid derivative with serum albumin: an insight by fluorescence and molecular modeling analysis Rational design of small molecule inhibitors targeting the Ras GEF, SOS1.Physicochemical characterization of a thermostable alcohol dehydrogenase from Pyrobaculum aerophilum Identification of a novel drug lead that inhibits HCV infection and cell-to-cell transmission by targeting the HCV E2 glycoprotein

P2860

Q21129288-9FD0A85C-F9DD-4264-99D2-04D2639E0A4C Q21199597-586FB56A-A783-4429-98E7-E285F3D10CAE Q21560757-EE0272C3-C3E5-464D-ACD4-21260F02BF4E Q22122067-AAB30559-C33E-496D-955B-10864990ACC2 Q23005474-928453CA-63E4-49E8-9EBF-BCBB13260764 Q24293288-3517C35C-9425-47E2-9BEE-06C7A0BA94E0 Q24307936-718E7817-D456-4479-AB3B-F64BAC65D1CA Q24336620-95F3F46C-0208-436D-950D-4395376F6B46 Q24609009-FC766575-41D2-48F4-9160-A258C31BAA71 Q24609899-5A6707AD-2A1D-4AF7-BB36-ECC77831F0DD Q24625172-641644E0-B20E-45BD-BB56-29BB4547A95C Q24629969-A53E14EF-2381-4F19-BD57-EA1408801BD5 Q24632720-716BD34C-8373-4483-A4A7-AAB91C7EA9A4 Q26740008-D4E2F9FE-C441-4884-BA66-E04CB41067E7 Q26743663-D45757B8-2A23-4EF7-AD1C-F879B8DD70F8 Q26745421-734DE23B-B46B-4179-84C6-543B09F8F3E2 Q26746941-2A022E6A-C223-411A-A01B-27C685DE89DD Q26747361-4453593F-0500-4481-90F4-EC26F4F8C60C Q26749162-C8AC28FB-05EA-4DE4-A5D2-85BE642BAA3B Q26750642-45718452-A212-4E7A-9B02-320591845796 Q26773062-97300405-82FA-4541-99CE-5D1778B50247 Q26776047-38ACABA9-9973-487A-AE48-64D7EE868B82 Q26823990-CC60AC85-49B4-42C2-A54E-CB2330E9FD41 Q26828848-9D0FF3D0-62FC-4456-A44D-5D807800C4F9 Q26864013-A42CA037-4FAA-4D08-B3C4-3E73BE81E26B Q27301793-DDC22E92-E979-4FDA-8A7B-3BDA0E1FE42C Q27303614-A4015BA1-25C1-4058-89B8-720460CA94D1 Q27305203-C60889FB-E9F9-4FE8-9850-A4A4F0A67B26 Q27309876-64BF59CD-81B8-47EF-98C1-76A76CE9A3EE Q27311427-FDB383AE-B882-4427-A81F-7BCD64DE48F0 Q27311652-7ABB8E4C-DDBF-4FEC-B47F-BE4F642956E6 Q27312038-B4728F54-BF89-41CD-B90F-73FCB831119B Q27313253-E5EF6407-C2C9-4B64-8F69-63B2364C1A9B Q27315022-0FAD7541-F192-4D41-A1F5-A57FBA28DA13 Q27316335-21B0CC8A-BF29-4109-A815-42BDE3BE97C5 Q27318392-897730D5-E1A7-4C07-A13C-CEBA9C8BC022 Q27318662-9DB5BF8B-FA7F-4E51-9A48-B27B7BAF04BC Q27318713-1016D076-10A7-4B61-8D85-4861E5210BEB Q27320034-B97C0667-4208-4671-9DDE-2B8F43C62C73 Q27333881-344F5992-1E95-4958-88D6-E7B1AB34AB4D

P2860

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

http://www.wikidata.org/entity/Q29547658

description

2009 nî lūn-bûn

@nan

2009 թուականի Դեկտեմբերին հրատարակուած գիտական յօդուած

@hyw

2009 թվականի դեկտեմբերին հրատարակված գիտական հոդված

@hy

2009年の論文

@ja

2009年論文

@yue

2009年論文

@zh-hant

2009年論文

@zh-hk

2009年論文

@zh-mo

2009年論文

@zh-tw

2009年论文

@wuu

name

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

@ast

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

@en

type

label

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

@ast

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

@en

prefLabel

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

@ast

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

@en

P1433

Q29547658-AD4C661E-BEEA-43D8-B9A1-ACDAA96F2F19

P1476

Q29547658-918CB2BB-953F-40A1-842C-A819E3933CF7

P2093

Q29547658-048CF845-F098-44DB-B4A8-F4F2E5E0A5F0

Q29547658-1C29C40D-9447-412A-A5E6-E4F09FD167FA

Q29547658-6F300251-7F27-4279-BB96-0D6580342DBC

Q29547658-CF3D1DD8-51AC-41FB-9EC4-EE381E61974B

Q29547658-D9012D91-26C3-4125-B77C-C4A2E32DCFA2

Q29547658-DB15D1D5-3286-4DB1-A393-0C478CEDA23F

P2860

Q29547658-30FE0554-B78C-4717-AEC2-7754454F33D8

Q29547658-33D9D208-B27F-4492-BA0F-3CE071BDA216

Q29547658-37925394-1082-4B0B-92C9-E3C8B85DB738

Q29547658-48996506-0385-498B-B0DA-100AC7C953D2

Q29547658-5A0396C9-48D7-4A41-8DD3-BE5F283350AA

Q29547658-85784059-835D-4468-9625-9D23375DB319

Q29547658-88CE9AF7-D8AF-4CFD-9C02-03652A8805EF

Q29547658-9F66E5B2-7832-4081-88EF-F36A7C2E4957

Q29547658-9FE77A25-211F-4A1E-858F-66A244F362E1

Q29547658-A79861DE-4BB9-486B-98DC-F6FC05D88164

P304

Q29547658-DFF7169E-3E4A-418B-9463-EE6BF44FC54B

P31

Q29547658-734D2E39-A98F-4F63-A9D4-940307DE0AA6

P3181

Q29547658-AD2F87A2-A9D4-4C3B-8092-D0E1F59E71F8

P356

Q29547658-3DED6F8F-1A47-4348-A1D5-8703E309CEBB

P407

Q29547658-E10E4C49-29C1-4373-9E12-9A3FD897CA7A

P433

Q29547658-A319803D-7979-4AC0-A16B-3BA8B3306E92

P478

Q29547658-EE10C26E-87AE-43E4-A531-51079CB83BEC

P50

Q29547658-28CA7D5F-CD07-4E1F-82A8-51AABF84701B

P577

Q29547658-EC2794B3-7A68-4E31-900C-F6C0B62C967B

P5875

Q29547658-09634454-1BCD-46E4-B7BC-E653262DDE17

P698

Q29547658-CCD6DB8A-FF18-4F0D-98F1-8DBD6D159F2B

P921

Q29547658-E7BE7637-B1DE-4317-AABA-0BB7FB8AF8AE

P932

Q29547658-223D55E9-456D-4403-800A-47BE2B919962

P3181

P356

P1433

Journal of Computational Chemistry

P1476

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

@en

P2093

Arthur J Olson

http://www.w3.org/2001/XMLSchema#string

David S Goodsell

http://www.w3.org/2001/XMLSchema#string

Michel F Sanner

http://www.w3.org/2001/XMLSchema#string

Richard K Belew

http://www.w3.org/2001/XMLSchema#string

Ruth Huey

http://www.w3.org/2001/XMLSchema#string

William Lindstrom

http://www.w3.org/2001/XMLSchema#string

P2860

Principles of docking: An overview of search algorithms and a guide to scoring functions

Automated docking of flexible ligands: applications of AutoDock

A semiempirical free energy force field with charge-based desolvation

Python: a programming language for software integration and development

Molecular recognition and docking algorithms.

A component-based software environment for visualizing large macromolecular assemblies.

Docking: successes and challenges.

Docking and scoring in virtual screening for drug discovery: methods and applications.

Automated docking of substrates to proteins by simulated annealing.

A review of protein-small molecule docking methods.

P304

2785-2791

http://www.w3.org/2001/XMLSchema#string

P31

scholarly article

P3181

276238

http://www.w3.org/2001/XMLSchema#string

P356

10.1002/JCC.21256

http://www.w3.org/2001/XMLSchema#string

P407

P433

16

http://www.w3.org/2001/XMLSchema#string

P478

30

http://www.w3.org/2001/XMLSchema#string

P50

Garrett M. Morris

P577

2009-12-01T00:00:00Z

http://www.w3.org/2001/XMLSchema#dateTime

P5875

24366776

http://www.w3.org/2001/XMLSchema#string

P698

19399780

http://www.w3.org/2001/XMLSchema#string

P921

P932

2760638

http://www.w3.org/2001/XMLSchema#string