Moemen National Liver Institute I have free online service, please if any one use one of these, could he tell us about it Cite 5 Recommendations 23rd Apr, 2013 Were L. L. Munyendo United States International University material studio would be an option in conjuction to the accelyrs Discovery studio Cite 1 Recommendation 23rd Apr, 2013 Yasmine S.
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Molecular Operating Environment 2019 Free Online ServiceMolecular Operating Environment 2019 Software For MolecularHappy docking. Nutan Cite 18 Recommendations All Answers (68) 16th Dec, 2012 Mohsen Yazdani Institute of Biochemistry and Biophysics Autodock is the best software for molecular docking Cite 16th Dec, 2012 Ricardo J Ferreira Red Glead Discovery You can try Autodock andor VINA for docking and USCF Chimera for QSAR. Molecular Operating Environment 2019 Download Autodock CiteCite 2 Recommendations Deleted profile from where i download Autodock Cite 16th Dec, 2012 Ricardo J Ferreira Red Glead Discovery To download, go to the webpage: Cite 2 Recommendations 16th Dec, 2012 Mohsen Yazdani Institute of Biochemistry and Biophysics First, you should download mgltools,then you can use autodock easily Cite 4 Recommendations 17th Dec, 2012 Nitish Mishra University of Nebraska Medical Center Autodock is best free software for dockingvirtual screening. But QSAR is not only docking, so what exactly you are looking for QSAR Cite 1 Recommendation 17th Dec, 2012 K. Venkateswara Swamy MIT- ADT University You can use following software for QSAR study Discovery studio or Tripos sybyl software,SimplePage,,,pageSYBYL-X or Vlife MDS Cite 1 Recommendation 17th Dec, 2012 Abdualrahman Mohammed Abdualkader Biopep Malaysia Sdn. Bhd. Nitish Mishra: Actually I am interested in both QSAR and Docking. Then, evaluate the model by docking results using 2D interaction diagram. Cite 18th Dec, 2012 Madhavan Gurram Connexios Life Sciences Sybol is better than Scridinger Cite 1 Recommendation 29th Dec, 2012 Yasmine S. Moemen National Liver Institute COMFA and COMSIA models by sybyl Cite 1 Recommendation 29th Dec, 2012 Yasmine S. Moemen National Liver Institute if you are using metalloproteins it is better to use QPLD in schrodinger suite Cite 6th Jan, 2013 Mohamed Saad Abdullah Elsayed Ain Shams University for docking you have many options: Autodock is the best I think as it has versatile way of performing your experiments and it can utilize various docking algorithms. Dock which is a freeware from UCSF QSAR can be done using any statistical software if you have the descriptors calculated. Both of Accelrys and Sybyl products are not free wares and they need licence for thier usage for 3D QSAR. ![]() With that, you can not only run docking, but also perform QSAR. Moreover, with docking approach, and with the new version of MOE 2012, including the Amber12: EHT force-field, for a given pose, you can easily perform minimization in order to obtain accurate dG. Other software which could be extremely useful is AutoDock Vina, which is free for academia, and for QSAR, as the result will extremely rely on the previous alignment, I recommend any software you can download, because having expermiental data about your ligands, all them predict very consistent and compatible outcomes. Moemen National Liver Institute if you aware of statistics,you can use Weka for QSAR Cite 1 Recommendation Deleted profile Please visit for most comprehensive and compact list of Drug Design,Docking,QSAR,modelling related softwares and servers (includes both free and paid) Cite 3 Recommendations 13th Apr, 2013 Chun-Wai Mai Shanghai Jiao Tong University Accelrys (Discovery Studio) provides a commercially industry validated software. ![]() Best regards, EP Cite 7 Recommendations 16th Apr, 2013 Chun-Wai Mai Shanghai Jiao Tong University Yup agreed to Enrico Perspicace ) Cite 19th Apr, 2013 Camillo Rosano Azienda Ospedaliera Universitaria San Martino di Genova Concerning free softwares I think AutodockADT (MGLtools) is the best choice. If you have money to spend, I agree with others here suggestin Sybyl package. However, the best poses are those furnished by GOLD (CCDC) Cite 8 Recommendations 22nd Apr, 2013 Yasmine S. Moemen National Liver Institute I have free online service, please if any one use one of these, could he tell us about it Cite 5 Recommendations 23rd Apr, 2013 Were L. L. Munyendo United States International University material studio would be an option in conjuction to the accelyrs Discovery studio Cite 1 Recommendation 23rd Apr, 2013 Yasmine S.
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