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Grid Service Orchestration Using the Business Process Execution Language (BPEL).

, , , , and . J. Grid Comput., 3 (3-4): 283-304 (2005)

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Significant progress in predicting the crystal structures of small organic molecules - a report on the fourth blind test, , , , , , , , , and 21 other author(s). Acta Cryst. B, 65 (2): 107--125 (April 2009)The orientation of N-H...O=C and N-H...N hydrogen bonds in biological systems: How good is a point charge as a model for a hydrogen bonding atom?, , and . J. Comput. Aided Mol. Des., 11 (5): 479-490 (1997)Crystal structure evaluation: calculating relative stabilities and other criteria: general discussion, , , , , , , , , and 31 other author(s). Faraday Discussions, (2018)Control and prediction of the organic solid state: a challenge to theory and experiment. Proceedings of the Royal Society A: Mathematical, Physical and Engineering Science, 474 (2217): 20180351+ (Sep 19, 2018)Is zeroth order crystal structure prediction (CSP\_0) coming to maturity? What should we aim for in an ideal crystal structure prediction code?. Faraday Discussions, (2018)Thermal Expansion of Carbamazepine: Systematic Crystallographic Measurements Challenge Quantum Chemical Calculations, , , , and . J. Phys. Chem. Lett., 8 (17): 4319--4324 (Sep 7, 2017)The potential of computed crystal energy landscapes to aid solid-form development, and . Drug Discovery Today, 21 (6): 912--923 (June 2016)Can computed crystal energy landscapes help understand pharmaceutical solids?, , and . Chem. Commun., 52 (44): 7065--7077 (2016)Applications of crystal structure prediction – organic molecular structures: general discussion, , , , , , , , , and 19 other author(s). Faraday Discussions, (2018)Unraveling Complexity in the Solid Form Screening of a Pharmaceutical Salt: Why so Many Forms? Why so Few?, , , , , , and . Crystal Growth & Design, 17 (10): 5349--5365 (Oct 4, 2017)