Lead Finder docking and virtual screening evaluation with Astex and DUD test sets (Q28266243)

2

0 references

Alexey A Zeifman

3

0 references

Oleg V Stroganov

4

0 references

Val Kulkov

5

0 references

Ghermes G Chilov

Journal of Computer - Aided Molecular Design

6

0 references

language of work or name

English

0 references

publication date

June 2012

0 references

published in

0 references

volume

26

0 references

issue

6

0 references

page(s)

725-35

0 references

cites work

Diverse, high-quality test set for the validation of protein-ligand docking performance.

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

A new test set for validating predictions of protein-ligand interaction.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

A critical assessment of docking programs and scoring functions

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

Benchmarking sets for molecular docking

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

Comparison of several molecular docking programs: pose prediction and virtual screening accuracy.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

Lead finder: an approach to improve accuracy of protein-ligand docking, binding energy estimation, and virtual screening

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

Optimization of CAMD techniques 3. Virtual screening enrichment studies: a help or hindrance in tool selection?

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

TSAR, a new graph–theoretical approach to computational modeling of protein side‐chain flexibility: Modeling of ionization properties of proteins

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

Improving performance of docking-based virtual screening by structural filtration.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

Developing novel approaches to improve binding energy estimation and virtual screening: a PARP case study

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

Can we trust docking results? Evaluation of seven commonly used programs on PDBbind database

21 January 2018

1 reference

https://api.crossref.org/works/10.1007/S10822-012-9549-Y

CSAR benchmark exercise of 2010: combined evaluation across all submitted scoring functions.

21 January 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22569592

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

CSAR Scoring Challenge Reveals the Need for New Concepts in Estimating Protein–Ligand Binding Affinity

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22569592

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1007/S10822-012-9549-Y

0 references

DBLP publication ID

journals/jcamd/NovikovSZSKC12

1 reference

DBLP Dataset 2021-01-02