Interdisciplinary Center for Nanotoxicity http://icnanotox.org Thu, 26 Jan 2012 21:35:11 +0000 en hourly 1 http://wordpress.org/?v=3.2.1 New CORAL (CORrelation And Logic) Software – CORALSEA http://feed.icnanotox.org/~r/nanotoxicity/~3/Vgnhr63NvE8/ http://icnanotox.org/2012/new-coral-correlation-and-logic-software-coralsea/#comments Thu, 26 Jan 2012 21:29:22 +0000 Bakhtiyor Rasulev http://icnanotox.org/?p=904 New CORAL (CORrelation And Logic) or CORALSEA is a freeware software developed together with Istituto di Ricerche Farmacologiche Mario Negri – Italy. It is a tool to build quantitative structure – property/activity relationships (QSPR/QSAR).

The CORALSEA can be used on Windows XP and Windows 7 operative systems. The molecular structure must be represented by SMILES (simplified molecular input line entry system). You can download the CORALSEA software as a zip file from the link provided. In the zip file you will find the documentation (ReadMe.pdf) about how to use the software and some examples.
DOWNLOAD CORAL SEA
Contacts:
aatoropov@yahoo.com (A.A. Toropov)
alla.toropova@marionegri.it (A.P. Toropova)

]]> http://icnanotox.org/2012/new-coral-correlation-and-logic-software-coralsea/feed/ 0 http://icnanotox.org/2012/new-coral-correlation-and-logic-software-coralsea/ Symposium on Methods and Applications of Computational Chemistry http://feed.icnanotox.org/~r/nanotoxicity/~3/WyVFmlxI490/ http://icnanotox.org/2011/methods-and-applications-of-computational-chemistry/#comments Mon, 16 May 2011 21:13:36 +0000 Olexandr Isayev http://icnanotox.org/?p=208 We invite you to participate in the third Symposium on Methods and Applications of Computational Chemistry (MACC-4) that will be held 28 June – 2 July 2011 in Lviv, Ukraine. Symposium will take place in main building of National University “Lviv Polytechnic” (12 St. Bandery Str.)

WORKING LANGUAGE
Official language of the Symposium is English. Please note that no translations wil be provided.

REGISTRATION AND ABSTRACT SUBMISSION
All participants are required to register for the conference through this site and pay the corresponding registration fees. The deadline for registration is shifted to 15 April 2011.

REGISTRATION FEE
Registration fee is 200 USD (or 150 EUR) for all participants, and should be paid in cash during registration. It covers participation, coffee breaks, printed Book of Abstracts, conference dinner, lunches, and city excursion. However, this fee does not cover accommodation.

Tentative list of invited speakers includes:

 

Alexey Arbuznikov (Germany) Xavier Assfeld (France)
Alexandr Bagaturyants (Russian Federation) Mikhail Basilevsky (Russian Federation)
Valerie Brenner (France) Jaroslav Burda (Czech Republic)
Remi Chauvin (France) Tim Clark (Germany)
David Close (USA) Michael Diedenhofen (Germany)
Frank Hagelberg (USA) Frances Hill (USA)
Volodymyr Ivashchenko (Ukraine) T. Marek Krygowski (Poland)
Viktor Kuz’min (Ukraine) Zdzislaw Latajka (Poland)
Christine Lepetit (France) Jerzy Leszczynski (USA)
Victor Lobanov (Ukraine) Istvan Mayer (Hungary)
Tanja van Mourik (United Kingdom) Evgeny Pidko (Netherlands)
Vladimir Poroikov (Russian Federation) Tomasz Puzyn (Poland)
Szczepan Roszak (Poland) Anatoly Ruvinsky (USA)
Andrzej Sokalski (Poland) Miquel Sola (Spain)
Jiri Sponer (Czech Republic) Ralf Tonner (Germany)
Serge S. Tratch (Russian Federation) Vladimir Tsirelson (Russian Federation)
Daniel Tunega (Austria) Jan Urban (Slovakia)
Alexandre Varnek (France)

All participants are required to register for the meeting online at:

http://xray.isc.kharkov.com/MACC-4/index.php?p=r

]]> http://icnanotox.org/2011/methods-and-applications-of-computational-chemistry/feed/ 0 http://icnanotox.org/2011/methods-and-applications-of-computational-chemistry/ 20th Conference on Current Trends in Computational Chemistry http://feed.icnanotox.org/~r/nanotoxicity/~3/2vdkz58-E0E/ http://icnanotox.org/2011/conference-on-current-trends-in-computational-chemistry/#comments Mon, 31 Jan 2011 20:00:09 +0000 Olexandr Isayev http://icnanotox.org/?p=338 We invite you to participate in the 20th Conference on Current Trends in Computational Chemistry organized together by Jackson State University and US Army ERDC. The CCTCC-20 meeting will be held at the Hilton Hotel in Jackson, Mississippi on October 27 -29, 2011.

Group Name:  Current Trends In Computational Chemistry Conference

Group Code:  CTICCC

Topics
The conference topics will include current progress in development of computational methods and their applications in research.

All details will be available in the nearest future at the conference web site at http://cctcc.icnanotox.org

]]> http://icnanotox.org/2011/conference-on-current-trends-in-computational-chemistry/feed/ 0 http://icnanotox.org/2011/conference-on-current-trends-in-computational-chemistry/ 11th Southern School on Computational Chemistry and Materials Science http://feed.icnanotox.org/~r/nanotoxicity/~3/89Y-slHJ-pQ/ http://icnanotox.org/2011/10th-southern-school-on-computational-chemistry-and-materials-science/#comments Thu, 27 Jan 2011 05:35:24 +0000 Olexandr Isayev http://icnanotox.org/?p=418

We invite you to participate in the 11th Southern School on Computational Chemistry and Materials Science Conference organized together by the members of the NSF-EPSCOR Computational Chemistry Cluster, NSF-CREST Interdisciplinary Center for Nanotoxicity, the NSF-Partnership for Research and Education for Materials (NSF-PREM) and Jackson State University. The meeting will be held at the Students Center of Jackson State University in Jackson, MS on July 28-29 (Thu and Fri), 2011.

The conference will gather some of the brightest minds in the field of theoretical and experimental nanoscience for a two-day symposium.  Some of the conference topics will include:


v     Nanomaterials in Biology & Medicine

v     Nanotoxicology

v     Computational Modeling

v     Environmental Nanotechnology

v     Polymeric Materials

v     Energetic Materials

v     Semiconductors


Registration Fees

$150 – Faculty & Staff before May 31, 2011

$200-  Faculty & Staff  after May 31, 2011

$75.00- Standard Student Fee

A tentaive schedule is available at  http://sscc.icnanotox.org/program.html

]]> http://icnanotox.org/2011/10th-southern-school-on-computational-chemistry-and-materials-science/feed/ 1 http://icnanotox.org/2011/10th-southern-school-on-computational-chemistry-and-materials-science/ “In vitro toxicity of engineered nanomaterials: Material Characterization and Challenges” http://feed.icnanotox.org/~r/nanotoxicity/~3/cetRUkAHx7s/ http://icnanotox.org/2011/%e2%80%9cin-vitro-toxicity-of-engineered-nanomaterials-material-characterization-and-challenges%e2%80%9d/#comments Tue, 04 Jan 2011 20:07:27 +0000 hassan http://icnanotox.org/?p=573 Our very first seminar for the semester will be held on Friday, January 14th, 2011. A talk entitled “In vitro toxicity of engineered nanomaterials: Material Characterization and Challenges” will be delivered by Dr. Saber Hussain, a senior scientist at the Applied Biotechnology, Human Effectiveness Directorate, Air Force Research Laboratory, WPAFB, OH. This will be held at the regularly scheduled time of 4pm at the Computational   Chemistry Conference Room.  Looking   forward to seeing you all there.

]]> http://icnanotox.org/2011/%e2%80%9cin-vitro-toxicity-of-engineered-nanomaterials-material-characterization-and-challenges%e2%80%9d/feed/ 0 http://icnanotox.org/2011/%e2%80%9cin-vitro-toxicity-of-engineered-nanomaterials-material-characterization-and-challenges%e2%80%9d/ Multiscale QM/MM Simulation Scheme for Biomolecular Systems http://feed.icnanotox.org/~r/nanotoxicity/~3/B6wNTNxKEwU/ http://icnanotox.org/2010/multiscale-qmmm-simulation-scheme-for-biomolecular-systems/#comments Wed, 22 Sep 2010 01:39:00 +0000 hassan http://icnanotox.org/?p=560 I am pleased to announce that for our second seminar of the semester, Dr. Pradip Biswas, the Interim Chair of the Department of Physics, and of the Computational Biophysics and Bioengineering Group, at Tougaloo College will be our speaker. He will deliver a talk on “Multiscale QM/MM Simulation Scheme for Biomolecular Systems.” This seminar will be held on September 24th in the Computational Chemistry Conference Room  at  4p.m.

]]> http://icnanotox.org/2010/multiscale-qmmm-simulation-scheme-for-biomolecular-systems/feed/ 0 http://icnanotox.org/2010/multiscale-qmmm-simulation-scheme-for-biomolecular-systems/ CORAL (CORrelation And Logic) Software http://feed.icnanotox.org/~r/nanotoxicity/~3/iygmxfZgu4I/ http://icnanotox.org/2010/coral-correlation-and-logic-software/#comments Thu, 26 Aug 2010 03:02:24 +0000 Olexandr Isayev http://icnanotox.org/?p=475 CHEMPREDICT/CORAL (CORrelation And Logic) is a freeware software developed together with Istituto di Ricerche Farmacologiche Mario Negri – Italy. It is a tool to build quantitative structure – property/activity relationships (QSPR/QSAR). The CORAL can be used on Windows xp and Windows Vista operative systems. The molecular structure must be represented by SMILES (simplified molecular input line entry system). You can download the CORAL software as a zip file. In the zip file you will find the documentation (ReadMe.pdf) about how to use the software and some examples.

DOWNLOAD CORAL 1.4


Contacts:

aatoropov@yahoo.com (A.A. Toropov)
altoropova@mail.ru (A.P. Toropova)

]]> http://icnanotox.org/2010/coral-correlation-and-logic-software/feed/ 0 http://icnanotox.org/2010/coral-correlation-and-logic-software/ Opportunities and Challenges in Micro and Nanotechnology Development for the US Army http://feed.icnanotox.org/~r/nanotoxicity/~3/FP5eNyLowqY/ http://icnanotox.org/2010/opportunities-and-challenges-in-micro-and-nanotechnology-development-for-the-us-army/#comments Tue, 04 May 2010 05:30:55 +0000 hassan http://icnanotox.org/2010/opportunities-and-challenges-in-micro-and-nanotechnology-development-for-the-us-army/ We will have a special seminar this Friday, May 7th, in the Just Science Hall (JSH), Room 250 at 10am. Dr. Madan Dubey from US Army Research Laboratory, Adelphi, MD, will deliver a talk on “Opportunities and Challenges in Micro and Nanotechnology Development for the US Army”

]]> http://icnanotox.org/2010/opportunities-and-challenges-in-micro-and-nanotechnology-development-for-the-us-army/feed/ 0 http://icnanotox.org/2010/opportunities-and-challenges-in-micro-and-nanotechnology-development-for-the-us-army/ 10th SSCC: Conference Program http://feed.icnanotox.org/~r/nanotoxicity/~3/GNCSyHXlhFY/ http://icnanotox.org/2010/10th-sscc-conference-program/#comments Tue, 20 Apr 2010 15:47:51 +0000 Olexandr Isayev http://icnanotox.org/?p=453 Conference program is available:

Schedule-SSMSCC-2010

Full conference book of proceedings

]]> http://icnanotox.org/2010/10th-sscc-conference-program/feed/ 0 http://icnanotox.org/2010/10th-sscc-conference-program/ Assessing In Vitro Cyto-toxicity of Engineered Nanomaterials with a Systematic Approach http://feed.icnanotox.org/~r/nanotoxicity/~3/Wh1b5hxYwv0/ http://icnanotox.org/2010/assessing-in-vitro-cyto-toxicity-of-engineered-nanomaterials-with-a-systematic-approach/#comments Wed, 14 Apr 2010 18:24:41 +0000 hassan http://icnanotox.org/?p=449 Our regularly scheduled friday seminar will be held this friday, April 16th,2010 at 4pm in JAP Rm 331. Dr.Huey-Min Hwang will present a talk on “Assessing In Vitro Cyto-toxicity of Engineered Nanomaterials with a Systematic Approach”. Looking forward to seeing you all.

]]> http://icnanotox.org/2010/assessing-in-vitro-cyto-toxicity-of-engineered-nanomaterials-with-a-systematic-approach/feed/ 0 http://icnanotox.org/2010/assessing-in-vitro-cyto-toxicity-of-engineered-nanomaterials-with-a-systematic-approach/