The Semiempirical Quantum Mechanical Scoring Function for In Silico Drug Design-Reference-Cited by-同舟云学术

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The Semiempirical Quantum Mechanical Scoring Function for In Silico Drug Design

Published:2013-08-13 Issue:9 Volume:78 Page:921-931
ISSN:2192-6506
Container-title:ChemPlusChem
language:en
Short-container-title:ChemPlusChem

Author:

Lepšík Martin,Řezáč Jan,Kolář Michal,Pecina Adam,Hobza Pavel,Fanfrlík Jindřich

Funder

Institute of Organic Chemistry and Biochemistry

Academy of Sciences of the Czech Republic

Czech Science Foundation

the European Social Fund

Publisher

Wiley

Subject

General Chemistry

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/cplu.201300199/fullpdf

Reference119 articles.

1. Spending on new drug development

2. The resurgence of covalent drugs

3. Direct measurement of protein binding energetics by isothermal titration calorimetry

4. Integrating surface plasmon resonance biosensor-based interaction kinetic analyses into the lead discovery and optimization process

5. Relationship between the inhibition constant (KI) and the concentration of inhibitor which causes 50 per cent inhibition (I50) of an enzymatic reaction

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4. Extensive Targeting of Chemical Space at the Prime Side of Ketoamide Inhibitors of Rhomboid Proteases by Branched Substituents Empowers Their Selectivity and Potency;2024

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