virtuallaboratory.org
Associative Neural Network
http://www.virtuallaboratory.org/lab/asnn
Http:/ www.vcclab.org. Virtual Computational Chemistry Laboratory. Welcome to the Associative Neural Network (ASNN). Java security issues: recently Java has dramatically increased security requirements to applets. Thus, please, follow instructions in this FAQ. To correcly setup access to the software. ASNN explicitly corrects bias of neural network ensemble = improved prediction ability;. Similarity in space of models makes possible to interpret the ASNN results = better modelling;. 16, 187-199, article.
eco-itn.eu
Research methodology | Environmental ChemOinformatics
http://www.eco-itn.eu/node/32.html
The basic tools used during the project and schools will include linear and non-linear methods of data analysis, including both supervised (linear regression, Support Vector Machines, neural networks) and unsupervised (self-organizing neural networks, hierarchical clustering analysis, etc.) approaches developed by the participants ( HMGU. And available at the Virtual Computational Chemistry Laboratory site ( VCCLAB. Site Importantly, TALETE. Available at the VCCLAB. Experimental tools and resources.
macinchem.org
Mac OS X Applications A-C | Macs in Chemistry
http://www.macinchem.org/applications/a-c.php
Mac OS X Applications A-C. Aabel :- Data Analysis. Is a new, and recently updated high performance data management, processing, and charting application for Mac OS X. It provides a superb visual front-end to high-performance statistical data analysis. It has over 200 data presentation styles and is capable of handling very large data sets. There is a review of Aabel 3.0. Abinit :- Density Functional Theory. ACPC:- Virtual screening of molecules using electrostatics. ADF2016 :- Density Functional Theory.
chemquestuk.com
Links
http://www.chemquestuk.com/page5.html
Societies and groups Academic and Gov Meetings and Conferences Journals. The Royal Society of Chemistry. The Society of Chemical Industry. Molecular Modelling Group -. The Cheminformatics and QSAR Society. RSC’s Chemical and Sciences Network. QSAR and Chemoinformatics Group. The American Chemical Society. Molecular Graphics Modelling Society. European Journal of Medicinal Chemistry. Journal of Chemical Information and Modelling. SAR and QSAR in Environmental Research. Journal of Medicinal Chemistry.
iqbalradetyo.blogspot.com
Kastil Pengetahuan: Desember 2011
http://iqbalradetyo.blogspot.com/2011_12_01_archive.html
Jumat, 30 Desember 2011. Ulasan Mengenai Beberapa Software Kimia Komputasi. Avogadro, Software Kimia Gratis untuk Edit Molekul. Apa yang dapat dilakukan Avogadro? Dapat melakukan pengunduhan secara langsung dari PDB (protein data bank). Atau PubChem (database dari molekul kimia dan aktivitasnya terhadap uji biologis). Inovatif “auto-optimation”, alat yang memungkinkan Anda untuk terus membangun dan memodifikasi, selama optimasi mekanika molekular. Antarmuka untuk banyak paket komputasi umum. Karena ukura...
fuadyhaniefcrb.blogspot.com
C-bond: Januari 2012
http://fuadyhaniefcrb.blogspot.com/2012_01_01_archive.html
Selasa, 03 Januari 2012. Download disini klik yah. Link ke posting ini. Kirimkan Ini lewat Email. Ubuntu 11.10 Review - Linux Distro Reviews. Link ke posting ini. Kirimkan Ini lewat Email. Subhanallah ( سبحان لله), Keagungan Allah dengan segala ciptaa-Nya, Sadar atau tidak Keagungan Allah selaman ini berada disekiling kita, contohnya garam dapur (NaCl) senyawa yang terdiri dari unsur-unsur yang berbahaya tetapi saat berikatan menjadi senyawa menjadi hal yang dibutuhkan bagi manusia, contoh lainnya air,.
virtuallaboratory.org
Virtual Computational Chemistry Laboratory Partners
http://www.virtuallaboratory.org/partners
Http:/ www.vcclab.org. Virtual Computational Chemistry Laboratory. The Virtual Computational Chemistry Laboratory was started as a collaborative project funded by INTAS. 2001 - 2004). Initially it comprised only contributions from the organisations that were awarded the grant INTAS Partners. Later on, an increasing number of New Partners. Has started to provide their computational resources for free open access at the VCCLAB site.
virtuallaboratory.org
Virtual Laboratory Software
http://www.virtuallaboratory.org/lab
Http:/ www.vcclab.org. Virtual Computational Chemistry Laboratory. Is the most accurate program to predict lipophilicity and aqueous solubility of molecules. Calculates highly predictive non-linear neural network models. Is molecular structure information interchange hub. Produces clearly interpretable analytical non-linear models. Generates more than 3000 descriptors. Implements original two-step descriptors selection procedure. Standalone version is free for academic and non for profit organisations.
eadmet.com
eADMET :: Products
http://www.eadmet.com/en/products.php
Our platform to create in silico ADME/Tox prediction models. OCHEM makes it easy to create precise models for properties of chemicals. Webbased, completely integrated development system for Structure-Property- und Structure-Activity Relationships (QSPR, QSAR). Contains a large database of physical und ADME/T properties. Requires only structural information. Supports the identification of the mode of action. Delivers background information for early stages of compound development. ALOGPS 2.1 has been ...
