(Q30980772)

27 June 2017

Pound-wise but penny-foolish: How well do micromolecules fare in macromolecular refinement? (English)

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27 June 2017

1 reference

1

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27 June 2017

2

Kim Henrick

1 reference

27 June 2017

Eleanor J Dodson

3

1 reference

PubMed ID

12962624

27 June 2017

Daan M F van Aalten

series ordinal

4

1 reference

27 June 2017

1 September 2003

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27 June 2017

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27 June 2017

11

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27 June 2017

1051-1059

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27 June 2017

9

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PRODRG, a program for generating molecular topologies and unique molecular descriptors from coordinates of small molecules.

27 June 2017

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Tables of bond lengths determined by X-ray and neutron diffraction. Part 1. Bond lengths in organic compounds

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

The Protein Data Bank

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

The Protein Data Bank: a computer-based archival file for macromolecular structures

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

A use of Ramachandran potentials in protein solution structure determinations

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

SWEET - WWW-based rapid 3D construction of oligo- and polysaccharides

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Reproducing the conformations of protein-bound ligands: a critical evaluation of several popular conformational searching tools

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

E-MSD: the European Bioinformatics Institute Macromolecular Structure Database

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Crystallographic R factor refinement by molecular dynamics

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

New software for searching the Cambridge Structural Database and visualizing crystal structures

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

CIF Applications. XI.A La Mode: a ligand and monomer object data environment. I. Automated construction of mmCIF monomer and ligand models

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Application and limitations of X-ray crystallographic data in structure-based ligand and drug design

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Accurate bond and angle parameters for X-ray protein structure refinement

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Automatic generation of 3D-atomic coordinates for organic molecules

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Stereochemically restrained refinement of macromolecular structures

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Errors in protein structures

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Improved methods for building protein models in electron density maps and the location of errors in these models

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Improving the quality of NMR and crystallographic protein structures by means of a conformational database potential derived from structure databases

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Improvements and Extensions in the Conformational Database Potential for the Refinement of NMR and X-ray Structures of Proteins and Nucleic Acids

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

The coupling of light-induced electron transfer and proton uptake as derived from crystal structures of reaction centres from Rhodopseudomonas viridis modified at the binding site of the secondary quinone, QB

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Main-chain bond lengths and bond angles in protein structures

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

GROMACS 3.0: a package for molecular simulation and trajectory analysis

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

XtalView/Xfit--A versatile program for manipulating atomic coordinates and electron density

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

D-amino acid residues in peptides and proteins.

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

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

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Stereochemical dictionaries for protein structure refinement and model building

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Comparison of Automatic Three-Dimensional Model Builders Using 639 X-ray Structures

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

Chirality errors in nucleic acid structures.

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

TNT refinement package

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

LIGPLOT: a program to generate schematic diagrams of protein-ligand interactions

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

SMILES. 2. Algorithm for generation of unique SMILES notation

1 reference

https://api.crossref.org/works/10.1016%2FS0969-2126%2803%2900186-2

7 January 2021

10.1016/S0969-2126(03)00186-2

Identifiers

DOI

1 reference

27 June 2017

1 reference

PubMed ID

12962624