Apr 19, 2008
PDB crossed more than 50,000 structures
With this week's update, the PDB archive reached a significant milestone in its 37-year history: The holdings now contain more than 50,000 current experimental structures.
Genome Sequenced
http://www.genomesonline.org/
Protein-Protein docking server
UCSF Chimera
This is very useful tool for graphical visualization. Taking pictures using chimera is the best. Even compared to commercially available molecular modeling softwares. check it out this http://www.cgl.ucsf.edu/chimera/
Apr 18, 2008
India Takes an Open Source Approach to Drug Discovery
Volume 133, Issue 2, 18 April 2008, Pages 201-203 , Cell
Apr 17, 2008
Getting Started in Text Mining
http://www.ploscompbiol.org/article/info%3Adoi%2F10.1371%2Fjournal.pcbi.0040020
Good English dictionary site
Indian journals push for clinical-trial registration
Eleven of India's leading medical journals will now consider publishing the results of clinical trials only if the trial in question has been registered with the Indian Council of Medical Research (ICMR) in New Delhi or any primary clinical-trial register.
The move follows the 2005 decision by the International Committee of Medical Journal Editors to publish only the results of registered trials. According to Kanikaram Satyanarayana, deputy chief of the ICMR, the delay was partly due to reluctance by the journal editors and pressure from industry. In addition, the ICMR had hoped that a bill it drafted in 2006 to regulate human trials would become law.
Trials that start in or after June of this year must be registered before enrolling their first participant; those beginning before this must register retrospectively. The ICMR says mandatory registration will ensure transparency and honesty, and discourage unethical trials.
An estimated 250 drug trials are under way in India, with applications for 30 more received on average each month.
Online file format conversion
http://www.zamzar.com/
List of published biological databases
Useful one.
Protein-Protein Interaction through text mining tool
Biodegradation Server(BPD server)
Interesting article in Biodegradation
The environmental fate of organic pollutants through the global microbial metabolism
The production of new chemicals for industrial or therapeutic applications exceeds our ability to generate experimental data on their biological fate once they are released into the environment. Typically, mixtures of organic pollutants are freed into a variety of sites inhabited by diverse microorganisms, which structure complex multispecies metabolic networks. A machine learning approach has been instrumental to expose a correlation between the frequency of 149 atomic triads (chemotopes) common in organo-chemical compounds and the global capacity of microorganisms to metabolise them. Depending on the type of environmental fate defined, the system can correctly predict the biodegradative outcome for 73–87% of compounds. This system is available to the community as a web server (http://www.pdg.cnb.uam.es/BDPSERVER). The application of this predictive tool to chemical species released into the environment provides an early instrument for tentatively classifying the compounds as biodegradable or recalcitrant. Automated surveys of lists of industrial chemicals currently employed in large quantities revealed that herbicides are the group of functional molecules more difficult to recycle into the biosphere through the inclusive microbial metabolism.
Apr 15, 2008
Molecular dynamics paper in science
Arkin IT, Xu H, Jensen MØ, Arbely E, Bennett ER, Bowers KJ, Chow E, Dror RO, Eastwood MP, Flitman-Tene R, Gregersen BA, Klepeis JL, Kolossváry I, Shan Y, Shaw DE.
D. E. Shaw Research, New York, NY 10036, USA.
Science. 2007 Aug 10;317(5839):799-803.
Na+/H+ antiporters are central to cellular salt and pH homeostasis. The structure of Escherichia coli NhaA was recently determined, but its mechanisms of transport and pH regulation remain elusive. We performed molecular dynamics simulations of NhaA that, with existing experimental data, enabled us to propose an atomically detailed model of antiporter function. Three conserved aspartates are key to our proposed mechanism: Asp164 (D164) is the Na+-binding site, D163 controls the alternating accessibility of this binding site to the cytoplasm or periplasm, and D133 is crucial for pH regulation. Consistent with experimental stoichiometry, two protons are required to transport a single Na+ ion: D163 protonates to reveal the Na+-binding site to the periplasm, and subsequent protonation of D164 releases Na+. Additional mutagenesis experiments further validated the model.
Apr 14, 2008
Secrets of Greatness
Progress toward Public Access to Science
http://biology.plosjournals.org/perlserv/?request=get-document&doi=10.1371/journal.pbio.0060101&ct=1
Apr 13, 2008
Notes to a young computational biologist
Want to be a UN Volunteer Online?
Steps to reach my goal
computer help
http://www.computerhope.com/