In silico screening of bioactive molecules using molecular integral equation theory

David S. Palmer; Andrey I. Frolov; Ekaterina L. Ratkova; Maxim V. Fedorov

In silico screening of bioactive molecules using molecular integral equation theory

David S. Palmer, Andrey I. Frolov, Ekaterina L. Ratkova, Maxim V. Fedorov

Research output: Contribution to journal › Conference abstract › peer-review

Abstract

This meeting abstract focuses on in silico screening of bioactive molecules using molecular integral equation theory

Original language	English
Article number	385-COMP
Journal	Abstracts of papers - American Chemical Society
Volume	243
Publication status	Published - 25 Mar 2012
Event	11th International Biorelated Polymer Symposium / 243rd National Spring Meeting of the American-Chemical-Society (ACS) - San Diego, United States Duration: 25 Mar 2012 → 29 Mar 2012

Keywords

in silico screening
bioactive molecules
molecular integral equation theory

ARCHIE-WeSt (UOSHPC)
Martin, R. (Manager)
University Of Strathclyde
Facility/equipment: Facility

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title = "In silico screening of bioactive molecules using molecular integral equation theory",

abstract = "This meeting abstract focuses on in silico screening of bioactive molecules using molecular integral equation theory",

keywords = "in silico screening, bioactive molecules, molecular integral equation theory",

author = "Palmer, {David S.} and Frolov, {Andrey I.} and Ratkova, {Ekaterina L.} and Fedorov, {Maxim V.}",

year = "2012",

month = mar,

day = "25",

language = "English",

volume = "243",

journal = "Abstracts of papers - American Chemical Society",

issn = "0065-7727",

publisher = "American Chemical Society",

note = "11th International Biorelated Polymer Symposium / 243rd National Spring Meeting of the American-Chemical-Society (ACS) ; Conference date: 25-03-2012 Through 29-03-2012",

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TY - JOUR

T1 - In silico screening of bioactive molecules using molecular integral equation theory

AU - Palmer, David S.

AU - Frolov, Andrey I.

AU - Ratkova, Ekaterina L.

AU - Fedorov, Maxim V.

PY - 2012/3/25

Y1 - 2012/3/25

N2 - This meeting abstract focuses on in silico screening of bioactive molecules using molecular integral equation theory

AB - This meeting abstract focuses on in silico screening of bioactive molecules using molecular integral equation theory

KW - in silico screening

KW - bioactive molecules

KW - molecular integral equation theory

M3 - Conference abstract

SN - 0065-7727

VL - 243

JO - Abstracts of papers - American Chemical Society

JF - Abstracts of papers - American Chemical Society

M1 - 385-COMP

T2 - 11th International Biorelated Polymer Symposium / 243rd National Spring Meeting of the American-Chemical-Society (ACS)

Y2 - 25 March 2012 through 29 March 2012

ER -

In silico screening of bioactive molecules using molecular integral equation theory

Abstract

Keywords

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ARCHIE-WeSt (UOSHPC)

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