Impacts of bioinformatics to medicinal chemistry

KC Chou - Medicinal chemistry, 2015 - ingentaconnect.com
Facing the explosive growth of biological sequence data, such as those of protein/peptide
and DNA/RNA, generated in the post-genomic age, many bioinformatical and mathematical …

An unprecedented revolution in medicinal chemistry driven by the progress of biological science

KC Chou - Current topics in medicinal chemistry, 2017 - benthamdirect.com
The eternal or ultimate goal of medicinal chemistry is to find most effective ways to treat
various diseases and extend human beings' life as long as possible. Human being is a …

The disposition of the LZCC protein residues in wenxiang diagram provides new insights into the protein–protein interaction mechanism

GP Zhou - Journal of Theoretical Biology, 2011 - Elsevier
Wenxiang diagram is a new two-dimensional representation that characterizes the
disposition of hydrophobic and hydrophilic residues in α-helices. In this research, the …

A brief review of computer-assisted approaches to rational design of peptide vaccines

A Nandy, SC Basak - International journal of molecular sciences, 2016 - mdpi.com
The growing incidences of new viral diseases and increasingly frequent viral epidemics
have strained therapeutic and preventive measures; the high mutability of viral genes puts …

Artificial intelligence techniques for colorectal cancer drug metabolism: ontologies and complex networks

M Martínez-Romero, JM Vázquez-Naya… - Current drug …, 2010 - benthamdirect.com
Colorectal cancer is one of the most frequent types of cancer in the world and generates
important social impact. The understanding of the specific metabolism of this disease and …

Drug discovery and design for complex diseases through QSAR computational methods

C R. Munteanu, E Fernández-Blanco… - Current …, 2010 - benthamdirect.com
There is a need for the study of complex diseases due to their important impact on our
society. One of the solutions involves the theoretical methods which are fast and efficient …

[HTML][HTML] 20D-dynamic representation of protein sequences

A Czerniecka, D Bielińska-Wąż, P Wąż, T Clark - Genomics, 2016 - Elsevier
A new method of comparison of protein sequences has been formulated. The sequence of
amino acids is represented by a set of point masses in a 20D space. The distribution of …

In Silico Study of Rotavirus VP7 Surface Accessible Conserved Regions for Antiviral Drug/Vaccine Design

A Ghosh, S Chattopadhyay, M Chawla-Sarkar… - 2012 - journals.plos.org
Background Rotaviral diarrhoea kills about half a million children annually in develo**
countries and accounts for one third of diarrhea related hospitalizations. Drugs and vaccines …

Global dynamics of an epidemic model with incomplete recovery in a complex network

A Lahrouz, A Settati, H El Mahjour, M El Jarroudi… - Journal of the Franklin …, 2020 - Elsevier
In this work, we study the global dynamics of a new SIRI epidemic model with
demographics, graded cure and relapse in a complex heterogeneous network. First, we …

Three 3D graphical representations of DNA primary sequences based on the classifications of DNA bases and their applications

G **e, Z Mo - Journal of theoretical biology, 2011 - Elsevier
In this article, we introduce three 3D graphical representations of DNA primary sequences,
which we call RY-curve, MK-curve and SW-curve, based on three classifications of the DNA …