(Q43558049)

24 November 2017

title

Ligand-protein inverse docking and its potential use in the computer search of protein targets of a small molecule (English)

1 reference

24 November 2017

Chen YZ

1 reference

24 November 2017

Zhi DG

series ordinal

1 reference

24 November 2017

language of work or name

English

0 references

publication date

1 May 2001

1 reference

24 November 2017

1 reference

24 November 2017

1 reference

24 November 2017

1 reference

24 November 2017

page(s)

217-226

1 reference

Structure-based strategies for drug design and discovery

24 November 2017

cites work

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

A geometric approach to macromolecule-ligand interactions

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

FLOG: a system to select 'quasi-flexible' ligands complementary to a receptor of known three-dimensional structure

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Flexible ligand docking using a genetic algorithm.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Development and validation of a genetic algorithm for flexible docking

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Molecular recognition of the inhibitor AG-1343 by HIV-1 protease: conformationally flexible docking by evolutionary programming

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

The computer program LUDI: a new method for the de novo design of enzyme inhibitors

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

A fast flexible docking method using an incremental construction algorithm.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Hammerhead: fast, fully automated docking of flexible ligands to protein binding sites.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

HOOK: a program for finding novel molecular architectures that satisfy the chemical and steric requirements of a macromolecule binding site

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

QXP: powerful, rapid computer algorithms for structure-based drug design

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Flexible docking using Tabu search and an empirical estimate of binding affinity.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Flexible ligand docking using conformational ensembles

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Predicting function: from genes to genomes and back

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

21 January 2018

The Protein Data Bank

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Bridging the protein sequence-structure gap by structure predictions

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Areas, volumes, packing and protein structure

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

The role of a minor groove spine of hydration in stabilizing poly(dA). poly(dT) against fuctuational interbase H-bond disruption in the premelting temperature regime

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Premelting base pair opening probability and drug binding constant of a daunomycin-poly d(GCAT).poly d(ATGC) complex

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Chem-X and CAMBRIDGE. Comparison of computer generated chemical structures with X-ray crystallographic data

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Steroidal and nonsteroidal oestrogen antagonists in breast cancer: basic and clinical appraisal

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Leu-enkephalin, tamoxifen and ethanol interactions: effects on motility and hepatic ethanol metabolizing enzymes

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Modulation of calmodulin plasticity in molecular recognition on the basis of x-ray structures

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Inhibition of cholinesterase activity by tetrahydroaminoacridine and the hemisuccinate esters of tocopherol and cholesterol

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Arachidonic acid metabolites as intratesticular factors controlling androgen production

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Lipoxygenase and other enzymes of arachidonic acid metabolism in the brain of chicks affected by nutritional encephalomalacia

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

High doses of multiple antioxidant vitamins: essential ingredients in improving the efficacy of standard cancer therapy.

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

A genetic algorithm based method for docking flexible molecules

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Distributed automated docking of flexible ligands to proteins: Parallel applications of AutoDock 2.4

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

Signalling the fat controller

21 January 2018

1 reference

https://api.crossref.org/works/10.1002%2F1097-0134%2820010501%2943%3A2%3C217%3A%3AAID-PROT1032%3E3.0.CO%3B2-G

10.1002/1097-0134(20010501)43:2<217::AID-PROT1032>3.0.CO;2-G

21 January 2018

Identifiers

DOI

1 reference

24 November 2017

1 reference