(Q34270284)

1 August 2017

FTMAP: extended protein mapping with user-selected probe molecules (English)

1 reference

1 August 2017

Dima Kozakov

7

0 references

author name string

Chi Ho Ngan

1

1 reference

1 August 2017

Tanggis Bohnuud

2

1 reference

1 August 2017

Scott E Mottarella

3

1 reference

1 August 2017

Dmitri Beglov

4

1 reference

1 August 2017

Elizabeth A Villar

5

1 reference

1 August 2017

David R Hall

6

1 reference

1 August 2017

Sandor Vajda

8

1 reference

1 August 2017

language of work or name

English

0 references

publication date

15 May 2012

1 reference

1 August 2017

Nucleic Acids Research

1 reference

1 August 2017

40

1 reference

1 August 2017

Web Server issue

1 reference

1 August 2017

W271-5

1 reference

Creative Commons Attribution-NonCommercial 3.0 Unported

1 August 2017

start time

5 October 2016

1 reference

April 2022 Public Data File from Crossref

copyright status

copyrighted

0 references

cites work

Hot spot analysis for driving the development of hits into leads in fragment-based drug discovery

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

FTSite: high accuracy detection of ligand binding sites on unbound protein structures

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Structural conservation of druggable hot spots in protein-protein interfaces

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Confab - Systematic generation of diverse low-energy conformers

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Domain motion and interdomain hot spots in a multidomain enzyme

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

The structural basis of pregnane X receptor binding promiscuity

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Fragment-based identification of druggable 'hot spots' of proteins using Fourier domain correlation techniques

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

The Blue Obelisk-interoperability in chemical informatics

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Application of fragment screening and fragment linking to the discovery of novel thrombin inhibitors.

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Automatic atom type and bond type perception in molecular mechanical calculations

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Druggability indices for protein targets derived from NMR-based screening data

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Development and testing of a general amber force field

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Fast, efficient generation of high-quality atomic charges. AM1-BCC model: II. Parameterization and validation

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Electrostatics of nanosystems: application to microtubules and the ribosome

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

6 July 2018

The Protein Data Bank

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Locating and characterizing binding sites on proteins

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

The molecular environment of the Na+ binding site of thrombin

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

Calculation of the total electrostatic energy of a macromolecular system: solvation energies, binding energies, and conformational analysis

6 July 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=3394268

General atomic and molecular electronic structure system

6 July 2018

1 reference

Crossref

https://api.crossref.org/works/10.1093%2FNAR%2FGKS441

CHARMM: A program for macromolecular energy, minimization, and dynamics calculations

21 January 2018

1 reference

Crossref

https://api.crossref.org/works/10.1093%2FNAR%2FGKS441

Organic solvents identify specific ligand binding sites on protein surfaces

21 January 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/22589414

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1093/NAR/GKS441

1 reference

journals/nar/NganBMBVHKV12

1 August 2017

1 reference

DBLP Dataset 2021-01-02

release_gfe4djzzhrguxft76l66kk3kfe

28 January 2021

Fatcat ID

1 reference

Fatcat

https://api.fatcat.wiki/v0/release/gfe4djzzhrguxft76l66kk3kfe

mapped directly with Wikidata item

24 November 2022

based on heuristic

PMCID

3394268

1 reference

1 August 2017

1 reference