(Q73604181)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

title

An automated method for predicting the positions of hydrogen-bonding atoms in binding sites (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

author name string

J E Mills

series ordinal

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

T D Perkins

series ordinal

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

P M Dean

series ordinal

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

publication date

1 May 1997

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

Journal of Computer - Aided Molecular Design

5 November 2019

published in

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

volume

11

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

issue

3

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

page(s)

229-242

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

https://scigraph.springernature.com/pub.10.1023/a:1007900527102

5 November 2019

exact match

0 references

cites work

The matching of electrostatic extrema: a useful method in drug design? A study of phosphodiesterase III inhibitors

1 reference

12 December 2020

Molecular structure matching by simulated annealing. I. A comparison between different cooling schedules

1 reference

12 December 2020

Molecular surface-volume and property matching to superpose flexible dissimilar molecules.

1 reference

12 December 2020

Identification of common functional configurations among molecules

1 reference

12 December 2020

Thiorphan and retro-thiorphan display equivalent interactions when bound to crystalline thermolysin

1 reference

12 December 2020

Molecular skins: a new concept for quantitative shape matching of a protein with its small molecule mimics

1 reference

12 December 2020

Automated site-directed drug design: the prediction and observation of ligand point positions at hydrogen-bonding regions on protein surfaces

1 reference

12 December 2020

Molecular shape comparison of angiotensin II receptor antagonists

1 reference

12 December 2020

Amino/aromatic interactions in proteins: is the evidence stacked against hydrogen bonding?

1 reference

12 December 2020

A genetic algorithm for flexible molecular overlay and pharmacophore elucidation.

1 reference

12 December 2020

Amino-aromatic interaction between histidine 197 of the neurokinin-1 receptor and CP 96345

1 reference

12 December 2020

A fast new approach to pharmacophore mapping and its application to dopaminergic and benzodiazepine agonists.

1 reference

12 December 2020

Three-dimensional hydrogen-bond geometry and probability information from a crystal survey

1 reference

12 December 2020

Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins.

1 reference

12 December 2020

Electrostatic complementarity between proteins and ligands. 1. Charge disposition, dielectric and interface effects

1 reference

12 December 2020

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

1 reference

12 December 2020

Automatic superposition of drug molecules based on their common receptor site

1 reference

12 December 2020

Molecular structure matching by simulated annealing. II. An exploration of the evolution of configuration landscape problems

1 reference

12 December 2020

Gene duplications in the structural evolution of chymotrypsin

1 reference

12 December 2020

Cation-pi interactions in chemistry and biology: a new view of benzene, Phe, Tyr, and Trp

1 reference

12 December 2020

Molecular structure matching by simulated annealing. III. The incorporation of null correspondences into the matching problem.

1 reference

12 December 2020

Automated site-directed drug design: a general algorithm for knowledge acquisition about hydrogen-bonding regions at protein surfaces.

1 reference

12 December 2020

Current computational tools for de novo ligand design

1 reference

12 December 2020

Different approaches toward an automatic structural alignment of drug molecules: applications to sterol mimics, thrombin and thermolysin inhibitors.

1 reference

12 December 2020

Derivation of a 3D pharmacophore model for the angiotensin-II site one receptor

1 reference

12 December 2020

Receptor surface models. 1. Definition and construction

1 reference

12 December 2020

The use of composite crystal-field environments in molecular recognition and the de novo design of protein ligands

1 reference

12 December 2020

Aromatic rings act as hydrogen bond acceptors

1 reference

12 December 2020

The search for functional correspondences in molecular structure between two dissimilar molecules.

1 reference

12 December 2020

Genetically evolved receptor models: a computational approach to construction of receptor models.

1 reference

12 December 2020

Identifiers

DOI

10.1023/A:1007900527102

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:9263850%20AND%20SRC:MED&resulttype=core&format=json

5 November 2019

DBLP publication ID

journals/jcamd/MillsPD97

1 reference

DBLP Dataset 2021-01-02

Dimensions Publication ID

28 January 2021

0 references

1 reference