Abstract: Embodiments of the invention provide a computer-implemented method that includes applying input representations of a three-dimensional (3D) domain to a generative neural network (GNN); and using the GNN to form a generative model of the 3D domain based at least in part on the input representations. The input representations include a global-shape input representation of the 3D domain.

Abstract: Aspects of the present invention disclose a method, computer program product, and system for optimizing a result for a combinatorial optimization problem. The method includes one or more processors receiving a black-box model. The method further includes one or more processors learning a multilinear polynomial surrogate model employing an exponential weight update rule. The method further includes one or more processors optimizing the learnt multilinear polynomial surrogate model. The method further includes one or more processors applying the black-box model to the optimized solution found by the multilinear polynomial surrogate model. In an additional aspect, the method of learning an optimized multilinear polynomial surrogate model employing an exponential weight update rule further includes one or more processors calculating utilizing data from the black-box model, an update of the coefficients of the multilinear polynomial surrogate model.

Abstract: Run a computerized numerical partial differential equation solver on at least one partial differential equation representing at least one physical constraint of a physical system, to generate a training data set. A true potential corresponds to an exact solution to the at least one partial differential equation. Using a computerized machine learning system, learn, from the training data set, a surrogate of a gradient of the true potential. Using the computerized machine learning system, apply Langevin sampling to the learned surrogate of the gradient, to obtain a plurality of samples corresponding to candidate designs for the physical system. Make the plurality of samples available to a fabrication entity.

Abstract: A query-based generic end-to-end molecular optimization (“QMO”) system framework, method and computer program product for optimizing molecules, such as for accelerating drug discovery. The QMO framework decouples representation learning and guided search and applies to any plug-in encoder-decoder with continuous latent representations. QMO framework directly incorporates evaluations based on chemical modeling, analysis packages, and pre-trained machine-learned prediction models for efficient molecule optimization using a query-based guided search method based on zeroth order optimization. The QMO features efficient guided search with molecular property evaluations and constraints obtained using the predictive models and chemical modeling and analysis packages.

Abstract: Integrated workflow visualization and editing is provided using a visual graphic diagramming tool and a web application platform tool to create a workflow. A visual representation of a workflow is created using the visual graphic diagramming tool. A declarative markup language file representing the workflow is provided to a web application platform tool for further modification of the workflow. The workflow is opened in the web application platform tool and desired parameters in the workflow are set. Visualization data from the graphic diagramming tool and the set parameters are bundled in a single declarative markup language file formatted for reading by both the visual graphic diagramming tool and the web application platform tool to allow manipulations and parameterization of the workflow in both the visual graphic diagramming tool and the web application platform tool.

Abstract: A system for providing workflow task customization comprises a workflow design tool communicating with a shared application platform. The workflow design tool is configured to receive a task customization selection, receive an initial task property selection, and upon receiving the initial task property selection, display a task customization user interface within the workflow design tool, the task customization user interface configured to receive one or more task property selections and receive a selection of a workflow item association from one or more workflow items stored by the shared application platform. The workflow design tool is further configured to generate a task including the one or more task property selections and associate the selected workflow item to the task.

Abstract: A method for providing workflow stages and integrated workflow stage visualization includes displaying a detailed view of a workflow, including a plurality of customizable stages, in the workflow user interface, wherein at least a first workflow stage of the plurality workflow stages is configured to contain a plurality of customizable workflow components, displaying the plurality of workflow components in the detailed view, receiving a selection of a stage view within the workflow user interface; displaying the stage view of the workflow, wherein the stage view includes the plurality of customizable stages but excludes the workflow components; and sending the workflow to the shared application platform.

Abstract: Integrated workflow visualization and editing is provided using a visual graphic diagramming tool and a web application platform tool to create a workflow. A visual representation of a workflow is created using the visual graphic diagramming tool. A declarative markup language file representing the workflow is provided to a web application platform tool for further modification of the workflow. The workflow is opened in the web application platform tool and desired parameters in the workflow are set. Visualization data from the graphic diagramming tool and the set parameters are bundled in a single declarative markup language file formatted for reading by both the visual graphic diagramming tool and the web application platform tool to allow manipulations and parameterization of the workflow in both the visual graphic diagramming tool and the web application platform tool.

Abstract: A system includes a workflow design application further including a user interface for displaying at least one project server platform type available for selection, and a project mode module configured to retrieve at least one available customizable project workflow component from the project server via a project server application programming interface (API). The user interface is configured to receive a project server platform type selection via the user interface, and, upon receiving the project server platform type selection, display the retrieved at least one customizable project workflow component, receive at least one customizable project workflow component selection, receive a customization selection for the selected customizable project workflow component, and receive a request to generate at least a portion of a project workflow based on the customization selection for the selected customizable project workflow component.

Abstract: A method is presented for creating a life cycle workflow for a project on a server computer. One or more workflow phases are created on the server computer. Each workflow phase corresponds to a plurality of workflow stages for the project. One or more workflow stages are created on the server computer. Each workflow stage corresponds to a specific sequence of workflow activities. One or more project detail pages are created on the server computer. Each project detail page is a web page that is made visible during the workflow stage. When a workflow stage is created, a workflow phase is selected to be associated with the workflow stage and one or more project detail pages are selected for the workflow stage.

Abstract: A broadband (8-18 GHz) radomed horn antenna system comprises a conical horn having broadband slots on the inner surface and a radome having a frusto-conical side wall and a spherically shaped transverse wall inserted into the horn. The radome wall is thin relative to operating wavelength. The radome side wall fits snugly against the inner surface of the horn wall so that transverse wall is proximate to the horn feed port with its convex side facing toward the horn aperture. The cylindrical feed guide contains a higher order hybrid mode suppressor which maintains a substantially uniform radiation pattern over the operating band with an acceptable insertion loss.

Abstract: Broadband (8-18 GHz) operation of a horn antenna with broadband corrugations is achieved by provision of dissipative TM.sub.11 mode suppressor means in the input waveguide feed to the horn. For a conical horn the input feed waveguide is circular and the mode suppressor means comprises a pair of axially extending diametrically spaced conductive wires or rods supported within the waveguide in dielectric foam, or alternatively, a cylindrical resistance card similarly supported coaxially with the waveguide. For a square corrugated horn of this type, the input waveguide is square and the mode suppressor means comprises a pair of parallel spaced axially extending resistance cards located in the planes of the magnetic field nulls in the waveguide.