(Q83816713)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

28 January 2020

title

Tautomers and topomers: challenging the uncertainties of direct physicochemical modeling (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

28 January 2020

author name string

Richard D Cramer

series ordinal

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

28 January 2020

publication date

21 March 2010

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

Journal of Computer - Aided Molecular Design

28 January 2020

published in

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

28 January 2020

volume

24

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

28 January 2020

issue

6-7

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

28 January 2020

page(s)

617-620

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

https://scigraph.springernature.com/pub.10.1007/s10822-010-9330-z

28 January 2020

exact match

0 references

1 reference

12 December 2020

"Lead hopping". Validation of topomer similarity as a superior predictor of similar biological activities

1 reference

12 December 2020

Do structurally similar molecules have similar biological activity?

1 reference

12 December 2020

Substructural analysis. Novel approach to the problem of drug design

1 reference

12 December 2020

Virtual screening for R-groups, including predicted pIC50 contributions, within large structural databases, using Topomer CoMFA.

1 reference

12 December 2020

What anions do inside a receptor's cavity: a trifurcate anion receptor providing both electrostatic and hydrogen-bonding interactions.

1 reference

12 December 2020

Structure-based virtual screening: an overview

1 reference

12 December 2020

A critical assessment of docking programs and scoring functions

1 reference

12 December 2020

Bioisosterism as a molecular diversity descriptor: steric fields of single "topomeric" conformers.

1 reference

12 December 2020

Prospective identification of biologically active structures by topomer shape similarity searching

1 reference

12 December 2020

Customizing scoring functions for docking

1 reference

12 December 2020

Topomers: a validated protocol for their self-consistent generation

1 reference

12 December 2020

Neighborhood behavior: a useful concept for validation of "molecular diversity" descriptors

1 reference

12 December 2020

1 reference

12 December 2020

Dbtop: topomer similarity searching of conventional structure databases

1 reference

12 December 2020

Quantifying uncertainty and sampling quality in biomolecular simulations

1 reference

12 December 2020

Nuclear-receptor ligands and ligand-binding domains

1 reference

12 December 2020

A comparison of ligand based virtual screening methods and application to corticotropin releasing factor 1 receptor

1 reference

12 December 2020

Topomer CoMFA: a design methodology for rapid lead optimization

1 reference

12 December 2020

AllChem: generating and searching 10(20) synthetically accessible structures.

1 reference

12 December 2020

10.1007/S10822-010-9330-Z

Identifiers

DOI

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20306282%20AND%20SRC:MED&resulttype=core&format=json

28 January 2020

DBLP publication ID

journals/jcamd/Cramer10

1 reference

DBLP Dataset 2021-01-02

28 January 2021

1 reference