(Q41766618)

English

Crystal landscape in the orcinol:4,4'-bipyridine system: synthon modularity, polymorphism and transferability of multipole charge density parameters.

scientific article published on October 2013

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scholarly article

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25075315%20AND%20SRC:MED&resulttype=core&format=json

11 March 2020

Crystal landscape in the orcinol:4,4'-bipyridine system: synthon modularity, polymorphism and transferability of multipole charge density parameters (English)

1 reference

Europe PubMed Central

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11 March 2020

2

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11 March 2020

author name string

Ritesh Dubey

1

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11 March 2020

Tayur N Guru Row

3

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11 March 2020

Gautam R Desiraju

4

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11 March 2020

publication date

1 October 2013

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11 March 2020

1 reference

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11 March 2020

1

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11 March 2020

Pt 1

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11 March 2020

8-18

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11 March 2020

Complex Polymorphic System of Gallic Acid-Five Monohydrates, Three Anhydrates, and over 20 Solvates

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

Nucleation of organic crystals--a molecular perspective.

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

Extending the supramolecular synthon based fragment approach (SBFA) for transferability of multipole charge density parameters to monofluorobenzoic acids and their cocrystals with isonicotinamide: importance of C-H···O, C-H···F, and F···F intermolec

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

Nucleation of crystals from solution: classical and two-step models.

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

Combining crystallographic information and an aspherical-atom data bank in the evaluation of the electrostatic interaction energy in an enzyme-substrate complex: influenza neuraminidase inhibition

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

A major advance in crystal structure prediction

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

A short history of SHELX

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

Crystal engineering: a holistic view

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

Introduction and validation of an invariom database for amino-acid, peptide and protein molecules.

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

Chemical applications of X-ray charge-density analysis

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

6 June 2018

The generalized invariom database (GID).

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

18 August 2018

Shape and size mimicry in the design of ternary molecular solids: towards a robust strategy for crystal engineering.

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

18 August 2018

"Higher density does not mean higher stability" mystery of paracetamol finally unraveled.

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

18 August 2018

Estimated H-atom anisotropic displacement parameters: a comparison between different methods and with neutron diffraction results.

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

18 August 2018

Van der waals and polar intermolecular contact distances: quantifying supramolecular synthons

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

18 August 2018

Supramolecular control of reactivity in the solid state: from templates to ladderanes to metal-organic frameworks

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

18 August 2018

Crystal engineering of pharmaceutical co-crystals from polymorphic active pharmaceutical ingredients

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

18 August 2018

An improved experimental databank of transferable multipolar atom models – ELMAM2. Construction details and applications

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

2 December 2018

Improving the scattering-factor formalism in protein refinement: application of the University at Buffalo Aspherical-Atom Databank to polypeptide structures

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=4104971

2 December 2018

Supramolecular construction of molecular ladders in the solid state

1 reference

https://pubmed.ncbi.nlm.nih.gov/25075315

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

Isonicotinamide self-association: the link between solvent and polymorph nucleation

1 reference

https://pubmed.ncbi.nlm.nih.gov/25075315

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

Computed Crystal Energy Landscapes for Understanding and Predicting Organic Crystal Structures and Polymorphism

1 reference

https://pubmed.ncbi.nlm.nih.gov/25075315

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

Molecular recognition in organic crystals: directed intermolecular bonds or nonlocalized bonding?

1 reference

https://pubmed.ncbi.nlm.nih.gov/25075315

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

Organic synthesis in the solid state via hydrogen-bond-driven self-assembly

1 reference

https://pubmed.ncbi.nlm.nih.gov/25075315

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

Structural landscape of benzoic acid: using experimental crystal structures of fluorobenzoic acids as a probe

1 reference

https://pubmed.ncbi.nlm.nih.gov/25075315

12 December 2020

based on heuristic

inferred from PubMed ID database lookup

Identifiers

10.1107/S2052252513024421

1 reference

Europe PubMed Central

PMC publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25075315%20AND%20SRC:MED&resulttype=core&format=json

11 March 2020

PMC publication ID

1 reference

Europe PubMed Central

PMC publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25075315%20AND%20SRC:MED&resulttype=core&format=json

11 March 2020

PubMed publication ID

1 reference

Europe PubMed Central

PMC publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:25075315%20AND%20SRC:MED&resulttype=core&format=json

11 March 2020

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