Schrödinger Suite 2013.1 (32bit)
Schrödinger Suite 2013.1 (32bit) | 3.9 Gb
Schrödinger Inc. announced 2013-1, the latest release of their entire suite of software programs, this covers tools for drug design, material science, biological modelling and general purpose modelling.
Scientific advances, significant usability improvements, and performance enhancements have been made to both the Small-Molecule Drug Discovery Suite and the Biologics Suite (featuring BioLuminate).
Schrödinger Suite 2013.1 (32bit)
There are a huge number of new features and improvements in the small molecule drug discovery suite as well as Materials Science. However a couple of features caught my eye, pKa prediction for both rule-based and QM-based methods has been improved. Covalent ligand docking has been added and includes a variety of common docking chemistries. Improved pi-stacking interactions in docking. The molecular dynamics has been updated and now includes support for GPU-acceleration. The QM tools look to have been updated and the interface improved. ADME tools have been updated and in particular P450 site of metabolism has improved accuracy.
Predictive capabilities that can be applied across a wide range of chemical systems, including ,Reaction thermochemistry and reaction path exploration ,Rate constants for reactions and transport from transition state theory ,Validated models for calculating oxidation and reduction potentials, Accurate heats of formation and atomization energies for larger systems, Reliable properties for systems containing transition metals,Efficient calculation of electric field dependent properties,Prediction of vibrational and electronic spectra for complex systems,Multiple pre-defined calculation modes representing tested simulation parameters balancing speed and accuracy.
There has also been an update to PYMOL with improved rendering speeds and a couple of bug fixes.
New features in Schrödinger Software Release 2013: here
Schrödinger Suite 2013.1 (32bit)
About Schrödinger, L.L.C.
Schrödinger, L.L.C. is a scientific leader in computational drug design for pharmaceutical and biotechnology research. The company makes significant investments in R&D, which has led to major advances in the field of computational chemistry. Schrödinger has achieved breakthroughs in quantum chemistry, molecular modeling, force fields, molecular dynamics, protein structure determination, and docking. Schrödinger's methods development and applications papers have over one thousand citations and are among the most-cited scientific publications. The company's full product offerings range from general molecular modeling programs to a comprehensive suite of drug design software, including both ligand- and structure based methods. Schrödinger, L.L.C. is located at 101 SW Main Street, Suite 1300, Portland, OR 97204.
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Name: Schrödinger Suite
Version: (32bit) 2013.1 Non Commercial
Home: www.schrodinger.com
Interface: english
OS: Windows XP / Vista / Seven
Size: 3.9 Gb
Special thanks pessoa1985 for Help in testing this release
Recovery volumes or .rev files are special files which can be created by WinRAR/RAR and allow you to reconstruct missing and damaged files in a volume set. They can
only be used with multi-volume archives.
This feature may be useful for backups or, for example, when you post a multivolume archive to a newsgroup and some of the subscribers did not receive some files. Reposting recovery volumes instead of usual volumes may reduce the total number of files to repost.
Each recovery volume is able to reconstruct one missing RAR volume. For example, if you have 30 volumes and 3 recovery volumes, you are able to reconstruct any 3 missing volumes. If the number of .rev files is less than a number of missing volumes, reconstructing is impossible. The total number of usual and recovery volumes must not exceed 255 and the number of recovery volumes must be less than the number of RAR volumes.
WinRAR reconstructs missing and damaged volumes either when clicking on .rev file, or when using rc command or automatically, if it cannot locate the next volume and finds the required number of .rev files when unpacking.
You may use the "Recovery volumes" option in the Archive name and parameters dialog or a similar option also appears in the Protect archive command to create recovery volumes. In the command line mode you may do it with -rv switch or rv command.
Original copies of damaged volumes are renamed to *.bad before reconstruction. For example, volname.part03.rar will be renamed to volname.part03.rar.bad.
From Win-rar.com
only be used with multi-volume archives.
This feature may be useful for backups or, for example, when you post a multivolume archive to a newsgroup and some of the subscribers did not receive some files. Reposting recovery volumes instead of usual volumes may reduce the total number of files to repost.
Each recovery volume is able to reconstruct one missing RAR volume. For example, if you have 30 volumes and 3 recovery volumes, you are able to reconstruct any 3 missing volumes. If the number of .rev files is less than a number of missing volumes, reconstructing is impossible. The total number of usual and recovery volumes must not exceed 255 and the number of recovery volumes must be less than the number of RAR volumes.
WinRAR reconstructs missing and damaged volumes either when clicking on .rev file, or when using rc command or automatically, if it cannot locate the next volume and finds the required number of .rev files when unpacking.
You may use the "Recovery volumes" option in the Archive name and parameters dialog or a similar option also appears in the Protect archive command to create recovery volumes. In the command line mode you may do it with -rv switch or rv command.
Original copies of damaged volumes are renamed to *.bad before reconstruction. For example, volname.part03.rar will be renamed to volname.part03.rar.bad.
From Win-rar.com
All parts on filepost.com, rapidgator.com, luckyshare.net interchanged. It is added by 5% of the overall size of the archive of information for the restoration and the volume for the restoration
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No mirrors please