Best ChemSketch Alternatives in 2025
Find the top alternatives to ChemSketch currently available. Compare ratings, reviews, pricing, and features of ChemSketch alternatives in 2025. Slashdot lists the best ChemSketch alternatives on the market that offer competing products that are similar to ChemSketch. Sort through ChemSketch alternatives below to make the best choice for your needs
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FindMolecule
FindMolecule
1 RatingFindMolecule, a new online inventory and ELN platform that enables biologists and chemists to find the right molecules, is a revolutionary online platform. It is used by labs around the globe to increase their efficiency. It is great for structure searches, barcode scanning and orders management. The electronic lab notebook is intuitive and the best on the market. -
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Chemical Safety Software
SFS Chemical Safety
10 RatingsChemical Safety provides a complete suite of safety and environmental software applications. GHS Labeling, Safety Data sheets, Chemical Inventory Tracking and Hazardous Waste Management are just a few of the features. -
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HyperProtein
Hypercube
HyperProtein is the latest offering from Hypercube, Inc., concentrating on the computational analysis of protein sequences. This innovative product not only examines one-dimensional sequences but also delves into the resulting three-dimensional structures of proteins. A key aspect of HyperProtein is its exploration of the intricate relationship between a protein's sequence and its structural form. In contrast to standalone software that targets specific functions like sequence alignment, HyperProtein combines a wide array of Bioinformatics and Molecular Modeling tools, providing a comprehensive approach to the science that begins with a protein sequence. By integrating these diverse tools, HyperProtein aims to enhance the understanding of protein functions and interactions at a molecular level, making it a valuable resource for researchers in the field. -
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MolPad
MolPad
MolPad seamlessly incorporates an interactive chemistry sketching tool into various online educational platforms. It allows educators to create open-ended questions regarding molecular structures and organic chemistry that extend beyond simply identifying correct answers. Explore how MolPad enhances online chemistry instruction through a low-code framework that facilitates the development of engaging content and intelligent assessments. Our platform has introduced multiple solutions for the intuitive drawing of structural formulas, allowing students to engage with concepts such as chemical nomenclature, functional groups, and Lewis structures in a digital setting. By offering targeted feedback based on individual mistakes, students can achieve a deeper understanding compared to traditional multiple-choice formats, ultimately fostering a richer learning experience in chemistry. Additionally, this interactive approach encourages students to think critically and creatively about chemical concepts. -
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Avogadro
Avogadro
Avogadro serves as a sophisticated molecular editor and visualizer that operates across multiple platforms, catering to fields such as computational chemistry, molecular modeling, bioinformatics, and materials science. With its ability to provide flexible, high-quality rendering alongside a robust plugin architecture, it enhances user experience significantly. This free, open-source tool is compatible with Mac, Windows, and Linux, making it accessible to a wide range of users in scientific disciplines. Its design emphasizes not only functionality but also adaptability to various research needs. -
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BIOVIA
Dassault Systèmes
BIOVIA solutions foster an unparalleled environment for scientific management, enabling organizations focused on science to develop and interlink innovations in biology, chemistry, and materials to enhance our quality of life. The leading BIOVIA portfolio emphasizes the seamless integration of diverse scientific disciplines, experimental workflows, and information needs throughout the entire spectrum of research, development, quality assurance, quality control, and manufacturing. It boasts capabilities spanning Scientific Informatics, Molecular Modeling and Simulation, Data Science, Laboratory Informatics, Formulation Design, BioPharma Quality and Compliance, as well as Manufacturing Analytics. BIOVIA is dedicated to accelerating innovation, boosting productivity, enhancing quality and compliance, lowering costs, and expediting product development for clients across various sectors. Additionally, it plays a crucial role in managing and unifying scientific innovation processes and information throughout the entire product lifecycle, ensuring a comprehensive approach to scientific advancement. -
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Structure Elucidator
ACD/Labs
Expert algorithms can help you to understand complex structures using experimental data. -
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Tox Suite
ACD/Labs
To reduce attrition rates for molecular entities that are unlikely succeed in nomination as drug candidates, direct new compound synthesizers, and focus animal testing requirements, calculate drug toxicity and safety. -
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ChemDraw
PerkinElmer
Since its inception in 1985, ChemDraw® solutions have delivered exceptional features and integrations that allow users to swiftly convert their concepts and sketches into impressive publications. ChemOffice+ Cloud serves as a comprehensive suite for chemistry communication, transforming chemical illustrations into valuable knowledge by streamlining the management, reporting, and presentation of chemistry research. This powerful suite is specifically designed to enhance and expedite communication within the field of chemistry. Building upon the foundation of ChemDraw Professional, ChemOffice+ Cloud offers a wide range of advanced tools that support scientific inquiry and collaboration. The once tedious process of drafting reports for chemical research is now significantly more efficient thanks to ChemOffice+ Cloud. With its robust capabilities for searching, reusing, selecting, and organizing chemical structures and data, chemists can effortlessly create polished PowerPoint presentations and manuscripts, making their work more accessible and impactful. This transformation not only saves time but also elevates the overall quality of research dissemination in the scientific community. -
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Chemaxon Marvin Pro
Chemaxon
Effortlessly create and share chemical structures using our online chemistry editor. Marvin Pro is a versatile drawing application that merges our advanced chemical intelligence with an intuitive interface. This tool empowers chemists, researchers, and students to quickly translate their ideas into visually appealing representations. With the capability to manage a multitude of objects, chemical structures, arrows, and text on a single canvas, Marvin Pro ensures precise alignment for all elements. Chemical editors should be user-friendly, and our solution makes it easy to visualize your chemical concepts clearly. The caliber of your drawings should reflect the dedication you invest in your research, and Marvin Pro enables you to produce high-quality visuals suitable for professional presentations. Let the canvas of Marvin Pro serve as an extension of your creativity, where you can incorporate predefined templates, color your structures, and include images from external sources. Additionally, you have the option to showcase the chemical formula alongside your structures, enhancing your visual communication even further. Whether you're drafting for a project or preparing for a presentation, Marvin Pro is designed to meet all your chemical visualization needs. -
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Ascalaph Designer
Agile Molecule
FreeAscalaph Designer is a versatile software designed for conducting molecular dynamic simulations. It integrates various implementations of molecular dynamics alongside classical and quantum mechanics methodologies from widely-used programs within a unified graphical interface. The software includes molecular geometry optimization utilizing conjugate gradient techniques. Molecular models are displayed in distinct windows, each equipped with dual camera views that enable simultaneous visualization from multiple angles and in various graphic representations. Users can easily open additional subwindows by adjusting the splitter located in the corner of each graphical display. By clicking an atom or bond with the left mouse button, users can slightly alter its color, and relevant information about the selected object is presented in the status bar. The wire-frame visualization style proves especially effective for large molecules, such as proteins, ensuring rapid rendering. Additionally, the CPK wire frame style effectively merges characteristics from several other visualization options, enhancing user experience. This program not only facilitates complex simulations but also significantly improves the analysis of molecular structures through its innovative display features. -
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ChemOffice
PerkinElmer Informatics
ChemOffice significantly boosts the efficiency of scientists by providing tools that allow them to systematically organize and investigate their compounds, reactions, and relevant properties, transforming raw data into valuable insights that facilitate more informed decision-making. Additionally, ChemDraw for Excel integrates chemical data into Excel, empowering chemists to leverage Excel's analytical capabilities to sort, organize, and enrich their compound datasets while investigating structure-activity relationships. Meanwhile, Chem3D allows chemists to create three-dimensional models of their compounds, enabling them to examine the spatial arrangement and properties of these molecules to optimize their efficacy or selectivity. Furthermore, ChemFinder functions as an intelligent personal database, assisting scientists in managing their compound collections and enabling them to search and correlate chemical structures with their properties effectively. This comprehensive suite of tools collectively streamlines the workflow for researchers, enhancing their ability to conduct high-quality scientific work. -
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PhysChem Suite
ACD/Labs
Calculate the physicochemical properties of organic compounds such as boiling point, aqueous solubility and logD, logP, pH, pKa, and other molecular descriptors from chemical structure. -
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Chemaxon Design Hub
Chemaxon
An integrated platform that bridges scientific reasoning, compound development, and computational tools is now available. Chemaxon’s Design Hub supports medicinal chemistry by facilitating the analysis and prioritization of innovative ideas. This unified platform allows users to design compounds and manage concepts seamlessly. Transitioning from traditional PowerPoint presentations to dynamic, visually engaging, and chemically searchable hypotheses enhances the compound design workflow. Users can conveniently utilize established physicochemical properties, computational models, novelty considerations, or accessible compound catalogs within an interactive visual setting. Collaborate with your Contract Research Organizations (CROs) in the compound development journey through this secure online resource. Furthermore, assess the gathered data from biological assays or experimental structural insights to derive Structure-Activity Relationships (SAR) and generate fresh hypotheses for subsequent optimization cycles. Your scientific ideas can be conveniently organized in a “designer's electronic lab notebook,” which features chemically aware drawing tools that streamline the design process. This comprehensive approach ensures that every step of compound development is efficient and well-documented, paving the way for future innovations. -
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PyMOL
PyMOL
PyMOL is a molecular visualization system that operates on a user-sponsored, open-source basis, with oversight and distribution managed by Schrödinger. The PyQt interface has replaced Tcl/Tk and MacPyMOL across all platforms, enhancing the user experience significantly. This software offers improved support for third-party plugins and custom scripting, making it a comprehensive tool for rendering and animating three-dimensional structures. Additionally, it includes a plug-in that allows users to incorporate 3D images and animations directly into PowerPoint presentations. Although PyMOL is a commercial product, the majority of its source code is accessible for free under a permissive license. This open-source initiative is sustained by Schrödinger and primarily funded through the sales of PyMOL licenses. Users benefit from open access to executables and a flexible evaluation policy. Recent updates feature an improved fuse command that prevents hypervalent bonds and replaces them with monovalent atoms instead, along with a properties inspector that now allows users to unset settings using the “delete” key. Furthermore, issues regarding the workspace disappearing at certain display resolutions have also been resolved, contributing to a more seamless experience for users. -
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Schrödinger
Schrödinger
Revolutionize the fields of drug discovery and materials research through cutting-edge molecular modeling techniques. Our computational platform, grounded in physics, combines unique solutions for predictive modeling, data analysis, and collaboration, facilitating swift navigation of chemical space. This innovative platform is employed by leading industries globally, serving both drug discovery initiatives and materials science applications across various sectors including aerospace, energy, semiconductors, and electronic displays. It drives our internal drug discovery projects, overseeing processes from target identification through hit discovery and lead optimization. Additionally, it enhances our collaborative research efforts aimed at creating groundbreaking medicines to address significant public health challenges. With a dedicated team of over 150 Ph.D. scientists, we commit substantial resources to research and development. Our contributions to the scientific community include more than 400 peer-reviewed publications that validate the efficacy of our physics-based methodologies, and we remain at the forefront of advancing computational modeling techniques. We are steadfast in our mission to innovate and expand the possibilities within our field. -
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ChemInventory
Antipodes Scientific
$56 per yearChemInventory streamlines the organization of your lab's chemical inventory, significantly reducing the time your team spends locating various compounds, allowing them to focus on their research tasks. This secure, cloud-enabled software facilitates effective management of chemical containers within your lab environment. Your team can quickly search for compounds using various criteria such as name, CAS registry number, molecular structure, or any custom fields you choose to define. Alongside the chemical structures, additional pertinent information is displayed in the search results for comprehensive insight. ChemInventory is compatible with all devices, including both PCs and Macs, ensuring that your inventory is not restricted to a single workstation. Our commitment to data security includes encrypting all information on our servers with the AES-256 standard, while daily backups safeguard against potential data loss. Furthermore, each container can be assigned a unique barcode, making inventory checks and stocktaking efficient and straightforward using a barcode scanner, which enhances the overall usability of the system. This innovative approach not only simplifies inventory management but also empowers research teams to operate more effectively and productively. -
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ACD/Name
ACD/Labs
Generate chemical names for structure and create structures from them according to IUPAC rules. It is capable of translating chemical names into more than 20 languages and handles difficult areas in nomenclature. -
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Khimera
Kintech Laboratory
Khimera serves as a tool for determining the kinetic parameters associated with microscopic processes, as well as the thermodynamic and transport characteristics of various substances and their mixtures within gases, plasmas, and at the gas-solid interface. Its main users include engineers and researchers who focus on developing kinetic models and engaging in thermodynamic and kinetic simulations pertinent to fields such as chemical engineering, combustion, catalysis, metallurgy, and microelectronics. This software is particularly well-suited for multi-scale modeling, as it connects the fundamental molecular properties of individual molecules with the ensemble-averaged characteristics of the reactive medium, encompassing thermodynamic and transport properties along with the rates of chemical reactions. Additionally, Khimera allows for the integration of quantum-chemical simulation results, enabling users to derive properties without requiring any experimental data from their side. By bridging the gap between different scales of modeling, Khimera enhances the understanding of complex systems in various scientific domains. -
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CADSIM Plus
Aurel Systems
CADSIM Plus is an innovative software designed for chemical process simulation, integrating a dynamic simulator based on first principles with a comprehensive Computer Assisted Drawing (CAD) interface all in one solution. It excels in conducting accurate heat and material balances across various chemical processes and is capable of creating intricate dynamic simulations that incorporate control logic and batch operations. The software is equipped with an extensive array of generic process modules and provides optional libraries tailored for diverse applications. CADSIM Plus accommodates a broad spectrum of drawing complexities, ranging from straightforward block diagrams to intricate engineering schematics, and facilitates the export of designs to AutoCAD and other conventional CAD software. With its 'electronic flowsheet' runtime simulation mode, users are provided with interactive and animated tools for simulation, allowing real-time adjustments to process conditions during operation. This versatile software finds applications in process design, troubleshooting, forecasting future process scenarios, and addressing challenges related to dynamic control, making it a valuable asset for engineers and researchers alike. Furthermore, its user-friendly interface ensures that even those new to process simulation can effectively harness its powerful capabilities. -
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LabCup
LabCup
LabCup is an all-encompassing enterprise system designed for chemical inventory management and laboratory administration in both industrial and academic research settings. Offering a comprehensive suite of software solutions tailored for laboratories and research institutions, LabCup includes features such as full chemical inventory management, risk assessment tools (including COSHH), equipment reservation, and asset tracking, along with real-time emergency information. Its extensive functionalities are modular, allowing users to select only the features they need, and it operates in the cloud, making it accessible on any device. Engineered with user-friendliness in mind, LabCup streamlines administrative tasks and automates various procedures; it efficiently integrates chemical data—including Safety Data Sheets (SDS), Globally Harmonized System (GHS) information, synonyms, molecular structures, and emergency protocols—into its system. Each chemical and item is distinctly identified and monitored through barcodes or IDs. Furthermore, LabCup supports multiple operational processes, encompassing COSHH risk assessments, equipment and room bookings, training documentation, a digital fire registry, purchasing management, radioactive materials tracking, and much more, making it an invaluable tool for laboratories aiming to enhance their efficiency and safety. -
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MoluCAD
New River Kinematics
MoluCAD is a comprehensive molecular modeling and visualization application specifically designed for Windows users. This tool emerged from a three-year research initiative funded by the National Institutes of Health, which focused on developing affordable educational software tailored for chemistry students. In its most recent iteration, MoluCAD includes numerous sophisticated features typically reserved for high-end modeling software found on expensive workstations. The application is characterized by its user-friendly interface, high-quality graphics, and strong computational capabilities. Even those who are new to molecular modeling can effortlessly create models, examine them from various angles, produce animations of chemical reactions, and store all related data on their devices. Additionally, MoluCAD serves as an invaluable resource for academic institutions looking to enhance their chemistry curriculum with accessible technology. -
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ChemDoodle
iChemLabs
$12.5 per month 1 RatingChemDoodle 2D boasts a plethora of features tailored for chemistry, enabling you to create high-quality graphics while significantly reducing your workload. We dedicate considerable time to analyzing the visual output generated by ChemDoodle. The software intelligently arranges bonds in the appropriate orientations, unifies bond strokes, optimizes the placement of attributes, and makes insightful choices that result in stunning and attractive visuals. However, you always have the option to adjust settings according to your tastes. Each element of the graphic can be tailored to your specifications, allowing you to modify bond widths, arrowhead dimensions, as well as the transparency and color of shapes. The drawing controls in ChemDoodle are designed to effectively represent the atoms and bonds they depict. Ample visual feedback is readily available, and a variety of options for personalizing the drawing tools accommodate individual preferences, including those related to accessibility. Ultimately, ChemDoodle empowers you to create visuals that meet both your aesthetic desires and functional needs. -
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BIOVIA Discovery Studio
Dassault Systèmes
The biopharmaceutical sector today is characterized by its intricacy, driven by increasing demands for enhanced specificity and safety, the emergence of new treatment classes, and the complexity of disease mechanisms. To navigate this intricate landscape, a profound comprehension of therapeutic dynamics is essential. Advanced modeling and simulation techniques offer a distinctive approach to investigate biological and physicochemical phenomena at the atomic scale. This methodology not only informs physical experimentation but also expedites the drug discovery and development phases. BIOVIA Discovery Studio integrates more than three decades of peer-reviewed research with cutting-edge in silico methodologies, including molecular mechanics, free energy assessments, and biotherapeutics developability, all within a unified framework. By equipping researchers with a comprehensive suite of tools, it facilitates a deeper examination of protein chemistry, thereby accelerating the discovery of both small and large molecule therapeutics, from Target Identification all the way through to Lead Optimization. Ultimately, this synergy of research and technology underscores the vital role of innovative tools in transforming biopharmaceutical advancements. -
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YASARA
YASARA
FreeYASARA is a versatile molecular graphics, modeling, and simulation software that was introduced in 1993 and is compatible with Windows, Linux, MacOS, and Android platforms, designed to simplify the process of obtaining answers to your scientific inquiries. Featuring a user-friendly interface and stunning photorealistic visuals, it also accommodates budget-friendly virtual reality headsets, shutter glasses, and autostereoscopic displays, fostering an immersive experience that allows users to concentrate on their objectives while minimizing distractions from the software itself. At the core of YASARA is PVL (Portable Vector Language), an innovative development framework that delivers performance capabilities that far exceed those of conventional applications. This advanced framework empowers users to visualize even the most complex protein structures and facilitates genuine interactive real-time simulations with precise force fields on standard computing systems, while also leveraging GPU capabilities when available. By enabling users to manipulate molecules actively and engage with dynamic models instead of just viewing static images, YASARA represents a significant advancement in molecular modeling technology. This dynamic interaction not only enhances the learning experience but also encourages deeper exploration of molecular behavior. -
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ArgusLab
ArgusLab
FreeArgusLab is a program designed for molecular modeling, graphics, and drug design, specifically for Windows platforms. While it may be somewhat outdated, it continues to enjoy a surprising level of popularity with over 20,000 downloads recorded. This software is available under a free license, which means you don't have to fill out any forms to access it. Educators can utilize as many copies as necessary for their classes, allowing students to benefit from ArgusLab’s features. However, it is important to note that redistributing ArgusLab from external websites is prohibited, although linking to the official site from your own is permitted. Currently, there is a modest initiative in progress to adapt ArgusLab for use on the iPad. Additionally, efforts have been made to integrate the Qt cross-platform development environment to potentially expand compatibility across Mac, PC, and Linux systems, enhancing its accessibility for a wider audience. This commitment to adaptability underscores the software's ongoing relevance in the field of molecular modeling. -
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LabCollector LIMS
AgileBio
$2500.00/one-time/ user LabCollector Lab Services Manager is a network-based software solution that assists core facilities, laboratories, biotechs, and other businesses. LabCollector LMS is simple and comprehensive. It allows users to manage a variety useful lab information. The solution includes powerful modules such as Strains & Cells Module and Sequences Module. -
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Promethium
Promethium
$30 per hourPromethium is an innovative platform for chemistry simulations that harnesses the power of GPUs to significantly speed up the development of drugs and materials by providing more efficient and precise quantum chemistry calculations. Specifically engineered for NVIDIA data center GPUs, such as the A100, it utilizes advanced QC Ware streaming algorithms to deliver remarkable computational speed and impressive power efficiency. This platform can perform density functional theory (DFT) calculations on molecular systems containing as many as 2,000 atoms, enabling researchers to conduct simulations of large molecular structures that traditional CPU-based ab initio methods cannot handle. For example, it can execute a single-point calculation for a protein with 2,056 atoms in just 14 hours using only one GPU. Promethium is equipped with a diverse array of functionalities, including single-point energy computations, geometry optimizations, conformer searches, torsion scans, reaction path optimizations, transition state optimizations, interaction energy evaluations, and relaxed potential energy surface explorations. Its capabilities make it a powerful tool for chemists looking to push the boundaries of molecular modeling and simulation. Ultimately, Promethium is set to transform the landscape of computational chemistry. -
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Chemical Watch
Chemical Watch
Chemical Watch stands out as the premier global source of unbiased intelligence and insights tailored for professionals in product safety who handle chemicals. Recognized as the most esteemed network for chemical safety and regulatory intelligence worldwide, it serves as a reliable ally for a diverse community of businesses, regulators, and various stakeholders. By becoming part of the Chemical Watch community, you can enhance your business's capabilities significantly. We offer a thorough and organized solution for product compliance data that spans regulations from all jurisdictions, accompanied by legal documentation, expert evaluations, and concise summaries. Participate in our virtual conferences, which feature interactive Q&A sessions, themed networking tables where you can consult experts, and engaging presentations, all from the convenience of your own space. In addition, you can connect with other participants and speakers in dedicated virtual networking sections, replicating the experience of a live event and fostering valuable relationships in the industry. This unique combination of resources and networking opportunities makes Chemical Watch an essential component of your professional toolkit. -
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AQChemSim
SandboxAQ
AQChemSim is an innovative cloud-based platform created by SandboxAQ that utilizes Large Quantitative Models (LQMs) based on principles of physics and chemistry to transform the landscape of materials discovery and enhancement. By incorporating techniques such as Density Functional Theory (DFT), Iterative Full Configuration Interaction (iFCI), Generative AI, Bayesian Optimization, and Chemical Foundation Models, AQChemSim facilitates precise simulations of molecular and material dynamics in real-world scenarios. The platform's features allow it to forecast performance under diverse stress conditions, expedite formulation via in silico testing, and investigate eco-friendly chemical processes. Remarkably, AQChemSim has achieved notable progress in battery technology, cutting the prediction time for lithium-ion battery end-of-life by 95%, while also attaining 35 times greater accuracy with a mere fraction of the data previously required. This advancement not only streamlines research but also paves the way for more efficient and sustainable energy solutions in the future. -
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Chemical Computing Group
Chemical Computing Group
Chemical Computing Group (CCG) is well-known for its dedication to collaborative scientific assistance. Operating from locations across North America, Europe, and Asia, our team, comprised of PhD-level scientists, partners closely with clients to deliver personalized support, practical training, and expert scientific guidance on a diverse array of projects. In addition to this, CCG is committed to the ongoing development of innovative technologies, leveraging the expertise of mathematicians, scientists, and software engineers while also engaging in scientific partnerships with our customers to enhance research outcomes. This collaborative approach not only improves client satisfaction but also fosters a culture of innovation within the organization. -
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CDD Vault
Collaborative Drug Discovery
CDD Vault allows you to intuitively organize chemical structures, biological study data, as well as collaborate with external or internal partners via a simple web interface. Start a free trial to see how easy it can be to manage drug discovery data. Tailored for You Affordable Scales with your project team Activity & Registration * Electronic Lab Notebook * Visualization * Inventory * APIs -
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NMR Predictors
ACD/Labs
Predict 1D & 2D NMR spectra of structures. ACD/Labs NMR predictors can speed up your workflow, from experimental design to data interpretation. Use ACD/NMR Predictors for: Predict a complete set 1D and 2D NMR spectrum for 1H, 13C and 15N nuclei. Calculate chemical shifts, coupling constants in just seconds - Train algorithms using in-house data to increase accuracy for new chemical space -
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BIOVIA CISPro
Dassault Systèmes
BIOVIA CISPro provides organizations with a comprehensive system to catalog all chemicals and materials at the container level within their facilities, ensuring real-time tracking and monitoring of usage. The platform supports an unlimited variety of material classes, including reference standards, and features robust security measures to protect sensitive information. Each business unit can manage its inventory independently, while still being part of a unified company account for streamlined oversight. CISPro equips users with essential tools for accurate tracking and reporting of chemicals and supplies, including controlled substances, while adhering to safety and regulatory standards through features like barcode labeling, remote inventory management, and Safety Data Sheet (SDS) organization. Generating reports is straightforward, enabling users to sort chemicals by various criteria such as location, vendor, name, CAS number, and formula. Most notably, it ensures that critical hazard information is readily accessible in the event of an emergency, enhancing overall safety and response readiness. This comprehensive approach not only facilitates compliance but also fosters a culture of safety within the organization. -
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NMR Workbook Suite
ACD/Labs
All your 1D and 2D NMR data can be processed, analyzed, and assembled. ACD/NMR Workbook Suite provides a complete NMR software program. It offers a complete suite of advanced processing, analysis and databasing functions for 1D and 2-D NMR data from all major vendors formats. With synchronized peak picking, assignment across multiple datasets, you can easily process and analyze NMR data. Verify chemical structures with confidence Analyze and quantify mixtures. Prepare comprehensive reports and publish-ready data. Manage, share, and store NMR spectra that are linked to structures. -
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IPA can also help analyze small-scale experiments that produce gene and chemical lists. IPA allows for targeted searches on genes, chemicals, and drugs. It also allows the creation of interactive models of experimental system. Data analysis and search capabilities allow for the understanding of the significance of data, targets, or candidate biomarkers within larger biological or chemical systems. The Ingenuity Knowledge Base contains highly structured, detail-rich chemical and biological findings that backs the software. Learn more about QIAGEN Ingenuity Pathway Analysis. Comparison Analysis determines which pathways, upstream regulators and diseases are most important. It can also be used to identify biological functions across time, doses, and other conditions.
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Swiss-PdbViewer
Swiss-PdbViewer
Swiss-PdbViewer, also known as DeepView, is a software tool that offers an intuitive interface for the simultaneous analysis of multiple proteins. Users can superimpose these proteins to determine structural alignments and evaluate various critical components, such as active sites. The application simplifies the process of obtaining information on amino acid mutations, hydrogen bonds, angles, and atomic distances through its easy-to-navigate graphical and menu-driven interface. Developed by Nicolas Guex since 1994, Swiss-PdbViewer was originally closely integrated with SWISS-MODEL, an automated homology modeling server created by the Swiss Institute of Bioinformatics (SIB) within the Structural Bioinformatics Group at the Biozentrum in Basel. Over time, the SWISS-MODEL web interface has progressed significantly, allowing for direct use in advanced modeling tasks. As a result, the complexity of maintaining a direct connection with Swiss-PdbViewer has led to the discontinuation of support for that integration. This evolution reflects broader changes in bioinformatics tools and their capabilities. -
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BatchMaster
BatchMaster Software
BatchMaster Manufacturing ERP Solutions can be used by formula-based process manufacturers in the Food, Chemical, Nutraceutical, and Life Sciences industries. Our software supports batch production, formulation, packaging management, batch production, quality and recall, lot traceability & rappel, industry-specific compliance, planning, scheduling, mobile warehousing, and other process manufacturing functions. Manufacturers can use their existing financial systems to run our process manufacturing application, including QuickBooks, Sage 100&300 and Microsoft Dynamics GP. We offer an ERP solution for manufacturers looking to replace or upgrade existing business systems. It supports specific manufacturing, financials and sales as well as supply chain, purchasing and customer service. Our applications are available on-premise (purchased), and in the cloud (monthly subscription programs). -
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Vertere Inventory Manager
Vertére
$290/month Vertére Inventory Manager: Smart Inventory for Scientific & Industrial Labs Vertére Inventory Manager is a robust, configurable platform for managing chemicals, lab supplies, equipment, and assets. Built for labs, research institutions, universities, and industrial environments, Vertére centralizes inventory data, improves safety, and streamlines compliance through intuitive, barcode-based workflows. With 30+ years of experience, Vertére supports complex lab operations with purpose-built modules: Chemical Inventory (ChIM): Barcode-level tracking, hazard classification, expiration alerts, and compliance reporting. Lab Supply Management: Manage consumables, reorder thresholds, stockroom workflows, and purchasing history. Equipment & Asset Tracking: Assign and track lab instruments with maintenance logs and calibration records. Chemical Waste Management: Track waste containers, accumulation dates, and generate EPA/DOT-compliant reports. SDS Management: Access a comprehensive, up-to-date SDS library directly within the platform. User Permissions & Access: Control visibility with role-based access, department segmentation, SSO, and 2FA. Key Benefits: ✔ Real-time visibility and control ✔ Centralized chemical safety and SDS access ✔ Scalable for single labs or multi-site institutions ✔ Flexible cloud or on-premise deployment Trusted by universities, government agencies, and Fortune 500 R&D teams. Vertére Inventory Manager: Inventory Made Simple -
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ImageWave
ImageWave
The EHS Enterprise Software Suite from ImageWave stands out as a premier, all-encompassing solution for managing environmental, health, and safety (EHS) concerns within various facilities throughout an organization. This versatile software can be utilized via the cloud or installed locally, offering features such as Safety Data Sheet (SDS) management, GHS label creation, SDS authoring, chemical inventory monitoring, and environmental reporting, among other functionalities. Additionally, its user-friendly interface ensures that organizations can efficiently navigate and implement the software to enhance their EHS practices. -
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CryoTrack
CryoTrack
CryoTrackIMS is a comprehensive software solution tailored for various fields, including molecular biology, cell banking, cellular biology, clinical samples, biorepositories, biobanking, biochemistry, immunology, and protein laboratories, as well as high-throughput screening, quality assurance, IVF labs, and core facilities. Users can effortlessly design any box, plate, or pie layout by choosing from rows and columns or opting for a pie configuration, allowing their custom box to be generated in mere seconds for data input. Efficient inventory management of precious biological samples and specimens is essential for both fundamental research and the biotech industry. Managing extensive collections of diverse samples such as DNA, RNA, plasmids, clones, proteins, peptides, probes, antibodies, enzymes, specimens, tissues, and cell lines can often become a challenging and overwhelming endeavor that results in significant financial costs alongside frustration and wasted time. CryoTrack provides an all-encompassing solution specifically designed for laboratories within universities, clinics, biotechnology firms, and pharmaceutical organizations. This advanced software not only simplifies sample tracking but also significantly enhances lab efficiency and productivity. By streamlining the organization of critical biological materials, CryoTrackIMS empowers researchers to focus more on their experiments and less on administrative burdens. -
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Reaxys
Elsevier
Reaxys is an online resource created by Elsevier that enables users to access a wealth of information regarding chemical substances and data sourced from published academic literature, including both journals and patents. This platform facilitates the retrieval of details about chemical compounds, reactions, properties, along with bibliographic and substance data, which includes synthesis planning guidance and experimental methods derived from a curated selection of journals and patents. Introduced in 2009 as a modern alternative to the CrossFire databases, Reaxys was crafted to provide research chemists with both contemporary and historical insights into organic, inorganic, and organometallic chemistry, all via a user-friendly interface. Spanning over two centuries of chemical research, it draws information from thousands of journal articles, books, and patents, ensuring a comprehensive resource. The database emphasizes data derived from specific journals and chemistry patents, prioritizing entries that feature a chemical structure, are validated by experimental data, and contain reliable citations, thus enhancing the credibility of the information provided. Furthermore, Reaxys continues to evolve, ensuring that it meets the ongoing needs of researchers in the ever-changing landscape of chemical research. -
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GreenCheck Software
APA Engineering
Ensuring adherence to compliance standards for Substances of Very High Concern (SVHC) presents a continuous challenge for businesses involved in the production of chemicals or products that contain them. The manual approaches currently in use are increasingly becoming cumbersome and complicated due to the rise in regulatory demands and the complexities of the supply chain, making scalability a significant issue. Companies must efficiently scale up and manage increased workloads, particularly during product launches and submission periods. Additionally, navigating intricate and extensive supply chains requires persistent communication and coordination with suppliers. To address these challenges, APA Engineering, leveraging over 19 years of expertise in product chemical compliance and supported by a worldwide client network, has developed a web-based SaaS solution designed to minimize costs and time while enhancing compliance reporting. The Greencheck software streamlines and automates many essential aspects of product chemical compliance, allowing users to obtain chemical composition details with a single click. Vendors can conveniently upload information directly, even through Excel files, enabling comprehensive compliance reporting through a unified dashboard that consolidates all relevant product chemical regulations, thus making compliance more manageable and efficient for all stakeholders involved. This innovative approach not only simplifies the compliance process but also significantly enhances the overall effectiveness of supply chain management. -
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MolView
MolView
FreeMolView is an engaging, open-source web tool designed to enhance the realms of science and education! Primarily, it serves as a platform for visualizing data online. Users can explore various scientific databases, such as those containing compounds, proteins, and spectra, and interact with the information presented through dynamic visualizations enabled by WebGL and HTML5 technologies. The development of this web application relies on several JavaScript libraries and online services. Additionally, the Virtual Model Kit has played a pivotal role in inspiring the creation of this innovative project, pushing the boundaries of how scientific data can be represented and understood. Ultimately, MolView aims to make scientific exploration more accessible and enjoyable for everyone. -
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Knowde
Knowde
Knowde is a specialized AI and software platform designed specifically for the chemical, ingredient, and polymer sectors. It establishes a clean and organized data infrastructure by seamlessly integrating supplier and product information, such as material specifications and regulatory performance details, which enhances various downstream applications like ERP, CRM, AI, ecommerce, and master data systems. Above this foundational data layer, the Knowde Customer Experience Platform functions as a comprehensive solution that enables chemical suppliers to maintain branded B2B digital storefronts, complete with integrated product catalogs, search functionalities, sampling options, quoting features, and rich content. Concurrently, Knowde operates a marketplace that allows buyers to explore, compare, sample, quote, and procure from over 8,000 supplier-owned storefronts, offering access to more than 230,000 ingredients, polymers, and raw materials globally, all accompanied by technical documentation, supplier insights, and procurement tools. This innovative platform not only streamlines the purchasing process but also empowers suppliers to enhance their digital presence and connect more effectively with potential customers.