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1Academic Journal
المؤلفون: Ola Fjellström, Sibel Akkaya, Hans-Georg Beisel, Per-Olof Eriksson, Karl Erixon, David Gustafsson, Ulrik Jurva, Daiwu Kang, David Karis, Wolfgang Knecht, Viveca Nerme, Ingemar Nilsson, Thomas Olsson, Alma Redzic, Robert Roth, Jenny Sandmark, Anna Tigerström, Linda Öster
المصدر: PLoS ONE, Vol 10, Iss 1, p e0113705 (2015)
وصف الملف: electronic resource
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2
المؤلفون: Jonas Henriksson, Anders Hogner, Ingemar Nilsson, Jonatan Enström, Johan Westin, Magnus Norrby, Farzad Faramarzi, Philip Werner, Christoph Grebner, Jonas Boström
المصدر: Future Medicinal Chemistry. 8:1739-1752
مصطلحات موضوعية: Models, Molecular, 0301 basic medicine, Computer science, Interface (Java), Virtual reality, Ligands, 03 medical and health sciences, Human–computer interaction, Drug Discovery, Humans, Web application, Pharmacology, Internet, Virtual screening, SIMPLE (military communications protocol), business.industry, Usability, Modular design, Visualization, Molecular Docking Simulation, 030104 developmental biology, Pharmaceutical Preparations, Drug Design, Quantum Theory, Molecular Medicine, business
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3
المؤلفون: C. Wern, Y. Örtengren, M. Strimfors, Ulf Eriksson, S. Nielsen, A.-C. Egnell, Ulf Bredberg, Joakim Bergman, T. Skjaeret, S. Pehrsson, Jonas Brånalt, K.-J. Hoffman, K. Abrahamsson, Ingemar Nilsson, Maria Ölwegård-Halvarsson, Polla Magnus, David Gustafsson, P. Andersson
المصدر: MedChemComm. 7:272-281
مصطلحات موضوعية: Pharmacology, chemistry.chemical_classification, 010405 organic chemistry, Chemistry, Organic Chemistry, Pharmaceutical Science, Prodrug, 010402 general chemistry, 01 natural sciences, Biochemistry, 0104 chemical sciences, Thrombin, Docking (molecular), Drug Discovery, medicine, Propionate, Molecular Medicine, Clinical evaluation, medicine.drug, Discovery and development of direct thrombin inhibitors
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4
المؤلفون: Hongming Chen, Ingemar Nilsson, Ulf Norinder, Lars Carlsson, Mats Eriksson, Peter Varkonyi
المصدر: Journal of Chemical Information and Modeling. 53:1324-1336
مصطلحات موضوعية: Pharmacology, Quantitative structure–activity relationship, Training set, business.industry, Computer science, General Chemical Engineering, Quantitative Structure-Activity Relationship, General Chemistry, Library and Information Sciences, Machine learning, computer.software_genre, Signature (logic), Computer Science Applications, Support vector machine, Correlation, Test case, Pharmaceutical Preparations, Artificial Intelligence, Drug Discovery, Artificial intelligence, business, computer, Algorithm, Algorithms, Scope (computer science)
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5
المؤلفون: Christian Tyrchan, Martin Johansson, Marcus Bjäreland, Mats Eriksson, Ingemar Nilsson, Thierry Kogej, Niklas Blomberg, Christopher Southan, Sorel Muresan
المصدر: Molecular Informatics
مصطلحات موضوعية: Structure (mathematical logic), Ibis, biology, Heuristic, Computer science, Organic Chemistry, Proteins, Full Papers, Commercial Sources, biology.organism_classification, chEMBL, computer.software_genre, Activity data, Computer Science Applications, Chemical structures, Set (abstract data type), Range (mathematics), Structural Biology, Drug Discovery, Molecular Medicine, Structure-activity relationships (SAR), Data mining, UniProt, computer
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6
المؤلفون: Samuel Genheden, Ulf Ryde, Ingemar Nilsson
المصدر: Journal of Chemical Information and Modeling; 51(Online March 18, 2011), pp 947-958 (2011)
مصطلحات موضوعية: Models, Molecular, Accuracy and precision, Indoles, Serine Proteinase Inhibitors, medicine.drug_mechanism_of_action, General Chemical Engineering, Factor Xa Inhibitor, Amidines, Molecular Conformation, Thermodynamics, Thermodynamic integration, Molecular Dynamics Simulation, Library and Information Sciences, Ligands, Molecular dynamics, Computational chemistry, Theoretical chemistry, medicine, Theoretical Chemistry, Binding affinities, Chemistry, Solvation, General Chemistry, Amides, Computer Science Applications, Drug Design, Factor Xa, Free energies, Algorithms, Factor Xa Inhibitors, Protein Binding
وصف الملف: application/pdf
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7
المؤلفون: Eric Therrien, Ingemar Nilsson, Ola Fjellström, David Gustafsson, Willem A. L. van Otterlo, Stephen Hanessian, Jianbin Zhang, Yafeng Xue
المصدر: Bioorganic & Medicinal Chemistry Letters. 19:5429-5432
مصطلحات موضوعية: Models, Molecular, Serine Proteinase Inhibitors, Pyridones, Stereochemistry, Clinical Biochemistry, Pharmaceutical Science, Crystallography, X-Ray, Biochemistry, Chemical synthesis, Thrombin, Drug Discovery, medicine, Animals, Humans, Trypsin, Molecular Biology, Serine protease, chemistry.chemical_classification, biology, Chemistry, Organic Chemistry, Biological activity, Enzyme, Enzyme inhibitor, biology.protein, Molecular Medicine, Cattle, Protein Binding, medicine.drug, Discovery and development of direct thrombin inhibitors
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8
المؤلفون: Eric Therrien, Malken Bayrakdarian, Daniel Simard, Stephen Hanessian, Ingemar Nilsson, Ola Fjellström
المصدر: Bioorganic & Medicinal Chemistry Letters. 18:1972-1976
مصطلحات موضوعية: Models, Molecular, Pyridones, Stereochemistry, Clinical Biochemistry, Pharmaceutical Science, Crystallography, X-Ray, Biochemistry, Chemical synthesis, Amidine, Structure-Activity Relationship, chemistry.chemical_compound, Thrombin, Drug Discovery, medicine, Humans, Trypsin, Amines, Molecular Biology, Serine protease, chemistry.chemical_classification, Sulfonamides, Molecular Structure, biology, Organic Chemistry, Biological activity, humanities, Protein Structure, Tertiary, Enzyme, chemistry, Enzyme inhibitor, Drug Design, biology.protein, Molecular Medicine, Protein Binding, medicine.drug
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9
المؤلفون: Gunnar Neovius, Lars Rex, Johan Styrud, Gunnar Ahlberg, Lars Granström, Staffan Haapaniemi, Ibrahim Badume, Ingemar Nilsson, Staffan Eriksson
المصدر: World Journal of Surgery. 30:1033-1037
مصطلحات موضوعية: Adult, Male, medicine.medical_specialty, Randomization, Adolescent, law.invention, Randomized controlled trial, Recurrence, law, medicine, Appendectomy, Humans, Antibacterial agent, business.industry, Middle Aged, Vascular surgery, Appendicitis, medicine.disease, Anti-Bacterial Agents, Surgery, Clinical trial, Cardiothoracic surgery, business, Abdominal surgery
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10
المؤلفون: Eric Therrien, Yafeng Xue, Ingemar Nilsson, Ola Fjellström, Willem A. L. van Otterlo, Stephen Hanessian, Malken Bayrakdarian
المصدر: Bioorganic & Medicinal Chemistry Letters. 16:1032-1036
مصطلحات موضوعية: Models, Molecular, Stereochemistry, Clinical Biochemistry, Pharmaceutical Science, Crystal structure, Crystallography, X-Ray, Biochemistry, Chemical synthesis, Antithrombins, Amidine, Structure-Activity Relationship, chemistry.chemical_compound, Thrombin, Phenols, Drug Discovery, medicine, Molecular Biology, Molecular Structure, biology, Organic Chemistry, Antithrombin, Anticoagulants, chemistry, Enzyme inhibitor, Drug Design, biology.protein, Molecular Medicine, circulatory and respiratory physiology, Discovery and development of direct thrombin inhibitors, medicine.drug
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11
المؤلفون: Eric Therrien, Stephen Hanessian, Ingemar Nilsson, Kenneth Granberg
المصدر: Bioorganic & Medicinal Chemistry Letters. 12:2907-2911
مصطلحات موضوعية: Models, Molecular, Spectrometry, Mass, Electrospray Ionization, Molecular model, Stereochemistry, Clinical Biochemistry, Molecular Conformation, Pharmaceutical Science, Factor VIIa, Inhibitory postsynaptic potential, Crystallography, X-Ray, Biochemistry, Chemical synthesis, Structure-Activity Relationship, Thrombin, Drug Discovery, medicine, Humans, Fibrinolysin, Binding site, Molecular Biology, Serine protease, biology, Chemistry, Organic Chemistry, Indolizines, General Medicine, In vitro, Design synthesis, Enzyme inhibitor, Docking (molecular), Drug Design, biology.protein, Molecular Medicine, medicine.drug
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12
المؤلفون: Anders Dahlgren, Per Johansson, Ingemar Kvarnström, Djordje Musil, Ingemar Nilsson, Bertil Samuelsson
المصدر: Bioorganic & Medicinal Chemistry. 10:1829-1839
مصطلحات موضوعية: Models, Molecular, Molecular model, medicine.drug_class, Stereochemistry, Morpholines, Clinical Biochemistry, Molecular Conformation, Pharmaceutical Science, Carboxamide, Tripeptide, Crystallography, X-Ray, Biochemistry, Chemical synthesis, Structure-Activity Relationship, Thrombin, Drug Discovery, medicine, Enzyme Inhibitors, Structural motif, Molecular Biology, biology, Chemistry, Molecular Mimicry, fungi, Organic Chemistry, food and beverages, Enzyme inhibitor, Drug Design, biology.protein, Molecular Medicine, Oligopeptides, medicine.drug, Discovery and development of direct thrombin inhibitors
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13
المؤلفون: Jonas Brånalt, Anders Dahlgren, Ingemar Nilsson, Djordje Musil, Bertil Samuelsson, Ingemar Kvarnström
المصدر: Bioorganic & Medicinal Chemistry. 10:1567-1580
مصطلحات موضوعية: Serine Proteinase Inhibitors, Proline, Stereochemistry, medicine.drug_class, Clinical Biochemistry, Pharmaceutical Science, Carboxamide, Tripeptide, Crystallography, X-Ray, Biochemistry, Chemical synthesis, Inhibitory Concentration 50, Structure-Activity Relationship, Thrombin, Drug Discovery, medicine, Humans, Structure–activity relationship, Amines, Tartrates, Molecular Biology, biology, Chemistry, Molecular Mimicry, Organic Chemistry, Anticoagulants, Enzyme inhibitor, biology.protein, Molecular Medicine, Oligopeptides, medicine.drug, Discovery and development of direct thrombin inhibitors
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14
المصدر: Tetrahedron Letters. 43:1995-1998
مصطلحات موضوعية: chemistry.chemical_compound, Enantiopure drug, chemistry, Stereochemistry, Aryl, Organic Chemistry, Drug Discovery, Biochemistry, Combinatorial chemistry
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15
المؤلفون: Mehran Seid, Ingemar Nilsson, Stephen Hanessian
المصدر: Tetrahedron Letters. 43:1991-1994
مصطلحات موضوعية: chemistry.chemical_classification, chemistry.chemical_compound, Adipic acid, Enantiopure drug, chemistry, Stereochemistry, Organic Chemistry, Drug Discovery, Nitroalkane, Piperidine, Biochemistry, Combinatorial chemistry, Sulfonamide
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16
المؤلفون: John G. Cumming, Hongming Chen, Mats Eriksson, Ingemar Nilsson, J. Willem M. Nissink, Lars Carlsson
المصدر: Journal of chemical information and modeling. 54(4)
مصطلحات موضوعية: Scheme (programming language), Quantitative structure–activity relationship, Support Vector Machine, General Chemical Engineering, Fingerprint (computing), Quantitative Structure-Activity Relationship, General Chemistry, Library and Information Sciences, computer.software_genre, Signature (logic), Computer Science Applications, Support vector machine, Nonlinear system, Nonlinear Dynamics, Encoding (memory), Data mining, computer, Interpretability, computer.programming_language, Mathematics
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17
المؤلفون: Marie Berghult, Ingemar Nilsson, Bryan J. Egner, Udo Bauer
المصدر: Tetrahedron Letters. 41:2713-2717
مصطلحات موضوعية: Sulfonyl, chemistry.chemical_classification, chemistry.chemical_compound, Template, chemistry, Reagent, Organic Chemistry, Drug Discovery, Pyrazoline, Biochemistry, Combinatorial chemistry, Solution phase synthesis
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18
المصدر: Bioorganic & Medicinal Chemistry Letters. 10:243-247
مصطلحات موضوعية: Models, Molecular, Molecular model, medicine.drug_class, Stereochemistry, Clinical Biochemistry, Pharmaceutical Science, Carboxamide, Crystallography, X-Ray, Biochemistry, Thrombin, Drug Discovery, medicine, Enzyme Inhibitors, Molecular Biology, chemistry.chemical_classification, Binding Sites, Molecular Structure, biology, Chemistry, Molecular Mimicry, Organic Chemistry, Active site, Stereoisomerism, Biological activity, Trypsin, Amino acid, Enzyme inhibitor, Molecular Probes, biology.protein, Molecular Medicine, Oligopeptides, medicine.drug
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19
المؤلفون: Ulf G. Eriksson, Ruth Bylund, Margareta Elg, O. Karlsson, Johanna Deinum, Henrik Toft Sørensen, Erika Gyzander, Christer Mattsson, Susanne Pehrsson, A. Nilsson, Ingemar Nilsson, Thomas Antonsson, David Gustafsson
المصدر: Scopus-Elsevier
مصطلحات موضوعية: Male, Benzylamines, Serine Proteinase Inhibitors, medicine.medical_treatment, Glycine, Administration, Oral, Biological Availability, Mice, Inbred Strains, Thrombin time, Pharmacology, Binding, Competitive, Rats, Sprague-Dawley, Mice, chemistry.chemical_compound, Dogs, Thrombin, Fibrinolytic Agents, Fibrinolysis, medicine, Animals, Protease Inhibitors, Molecular Structure, medicine.diagnostic_test, Chemistry, Hemodynamics, Hematology, Rats, Molecular Weight, Clotting time, Coagulation, Biochemistry, Azetidines, Inogatran, Platelet Aggregation Inhibitors, medicine.drug, Partial thromboplastin time, Discovery and development of direct thrombin inhibitors
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20
المؤلفون: Ingemar Nilsson, Polla Magnus
المصدر: Journal of computer-aided molecular design. 26(10)
مصطلحات موضوعية: Scheme (programming language), Propagation of uncertainty, Computer science, business.industry, Experimental data, Quantitative Structure-Activity Relationship, computer.software_genre, Machine learning, Project team, Models, Biological, Computer Science Applications, Ranking (information retrieval), Task (project management), Ranking SVM, Test set, Drug Design, Drug Discovery, Humans, Receptor, Melanocortin, Type 4, Data mining, Artificial intelligence, Physical and Theoretical Chemistry, business, computer, computer.programming_language
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