#Hyperdock vs free

Solving molecular flexible docking problems with metaheuristics: A comparative study. Esteban LГіpez-Camacho, MarГa JesГєs GarcГa-Godoy, JosГ© GarcГa-Nieto, Antonio J.

In Proceedings of the Tenth SIAM Conference on Parallel Processing for Scientific Computing. The Many Roles of Computation in Drug Discovery. Journal of Chemical Information and Modeling 45, 1 (2005), 177-182.

#Hyperdock vs free

ZINC-a free database of commercially available compounds for virtual screening. The International Journal of High Performance Computing Applications (March 2017). METADOCK: A Parallel Metaheuristic schema for Virtual Screening methods (In press). Cecilia, Horacio PГ©rez-SГЎnchez, and Domingo GimГ©nez. Algorithmics for Hard Problems (second ed.). Concurrency and Computation: Practice and Experience 26, 10 (2014), 1832-1846. Toward energy efficiency in heterogeneous processors: findings on virtual screening methods. GinГ©s D Guerrero, Juan M CebriГЎn, Horacio PГ©rez-SГЎnchez, JosГ© M GarcГa, Manuel UjaldГіn, and JosГ© M Cecilia.Glide: A New Approach For Rapid, Accurate Docking and Scoring: Method and Assessment of Docking Accuracy. Richard A Friesner, Jay L Banks, Robert B Murphy, Thomas A Halgren, Jasna J Klicic, Daniel T Mainz, Matthew P Repasky, Eric H Knoll, Mee Shelley, Jason K Perry, and et al.Journal of Computer-Aided Molecular Design 15, 5 (2001), 411-428. DOCK 4.0: Search strategies for automated molecular docking of flexible molecule databases. In Computational Collective Intelligence. Parallel Flexible Molecular Docking in Computational Chemistry on High Performance Computing Clusters. Rafael Dolezal, Teodorico C Ramalho, Tanos CC FranГ§a, and Kamil Kuca.In Proceedings of the Genetic and Evolutionary Computation Conference, GECCO 2015, Madrid, Spain, July 11-15, 2015. Hyperheuristics Based on Parametrized Metaheuristic Schemes. JosГ©-MatГas Cutillas-Lozano, Domingo GimГ©nez, and Francisco Almeida.International Workshop on Optimization and Learning: Challenges and Applications. Landscape Analysis for the Improvement of Hyperheuristics over Parameterized Metaheuristics. Cecilia, JosГ©-MatГas Cutillas-Lozano, Domingo GimГ©nez, and Baldomero ImbernГіn. Exploiting multilevel parallelism on a many-core system for the application of hyperheuristics to a molecular docking problem. Metaheuristics in combinatorial optimization: Overview and conceptual comparison. Hybrid metaheuristics in combinatorial optimization: A survey. Christian Blum, Jakob Puchinger, GГјnther R.

IEEE Transactions on Systems, Man and Cybernetics, Part A: Systems and Humans 43, 3 (2013), 570-586. Parameterised schemes of metaheuristics: basic ideas and applications with Genetic algorithms, Scatter Search and GRASP.

Springer Science, St, New York, NY, 10013 United States. In 10h International Conference on Computational and Mathematical Methods in Science and Engineering. A parameterised shared-memory scheme for parameterised metaheuristics.