부산대학교 도서관

Aranda-Garcia, David; Stepniewski, Tomasz Maciej; Torrens-Fontanals, Mariona; Garcia-Recio, Adrian; Lopez-Balastegui, Marta; Medel-Lacruz, Brian; Morales-Pastor, Adrian; Peralta-Garcia, Alejandro; Dieguez-Eceolaza, Miguel; Sotillo-Nunez, David; Ding, Tianyi; Drabek, Matthäus; Jacquemard, Celien; Jakowiecki, Jakub; Jespers, Willem; Jimenez-Roses, Mireia; Jun-Yu-Lim, Victor; Nicoli, Alessandro; Orzel, Urszula; Shahraki, Aida; Tiemann, Johanna K. S.; Ledesma-Martin, Vicente; Nerin-Fonz, Francho; Suarez-Dou, Sergio; Canal, Oriol; Pandy-Szekeres, Gaspar; Mao, Jiafei; Gloriam, David E.; Kellenberger, Esther; Latek, Dorota; Guixa-Gonzalez, Ramon; Gutiérrez-de-Terán, Hugo; Tikhonova, Irina G.; Hildebrand, Peter W.; Filizola, Marta; Babu, M. Madan; Di Pizio, Antonella; Filipek, Slawomir; Kolb, Peter; Cordomi, Arnau; Giorgino, Toni; Marti-Solano, Maria; Selent, Jana

Nature Communications. 16

Stepniewski, TM; Mancini, A; Agren, R; Torrens-Fontanals, M; Semache, M; Bouvier, M; Sahlholm, K; Breton, B; Selent, J

CHEMICAL SCIENCE. 12(33):10990-11003

Mariona Torrens-Fontanals; Tomasz M. Stepniewski; David E. Gloriam; Jana Selent

Current Opinion in Structural Biology

Torrens-Fontanals M; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona 08003, Spain.; Peralta-García A; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona 08003, Spain.; Talarico C; EXSCALATE, Dompé Farmaceutici S.p.A., Via Tommaso De Amicis, 95, Napoli, 80131, Italy.; Guixà-González R; Laboratory of Biomolecular Research, Paul Scherrer Institute, CH-5232 Villigen PSI, Switzerland.; Condensed Matter Theory Group, Paul Scherrer Institute, CH-5232 Villigen PSI, Switzerland.; Giorgino T; Biophysics Institute (CNR-IBF), National Research Council of Italy, Milan 20133, Italy.; Department of Biosciences, University of Milan, Milan 20133, Italy.; Selent J; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona 08003, Spain.

Publisher: Oxford University Press Country of Publication: England NLM ID: 0411011 Publication Model: Print Cited Medium: Internet ISSN: 1362-4962 (Electronic) Linking ISSN: 03051048 NLM ISO Abbreviation: Nucleic Acids Res Subsets: MEDLINE

Torrens-Fontanals M; Acellera Labs, C Dr Trueta 183, 08005 Barcelona, Spain.; Tourlas P; Acellera Labs, C Dr Trueta 183, 08005 Barcelona, Spain.; Doerr S; Acellera Labs, C Dr Trueta 183, 08005 Barcelona, Spain.; De Fabritiis G; Computational Science Laboratory, Universitat Pompeu Fabra, Barcelona Biomedical Research Park (PRBB), C Dr. Aiguader 88, 08003 Barcelona, Spain.; Acellera, Devonshire House, 582 Honeypot Lane, HA7 1JS Stanmore Middlesex, United Kingdom.; Institució Catalana de Recerca i Estudis Avançats (ICREA), Passeig Lluis Companys 23, 08010 Barcelona, Spain.

Publisher: American Chemical Society Country of Publication: United States NLM ID: 101230060 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1549-960X (Electronic) Linking ISSN: 15499596 NLM ISO Abbreviation: J Chem Inf Model Subsets: MEDLINE

Morales-Pastor A; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Medicine and Life Sciences, Pompeu Fabra University, 08003 Barcelona, Spain.; Nerín-Fonz F; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Medicine and Life Sciences, Pompeu Fabra University, 08003 Barcelona, Spain.; Aranda-García D; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Medicine and Life Sciences, Pompeu Fabra University, 08003 Barcelona, Spain.; Dieguez-Eceolaza M; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Medicine and Life Sciences, Pompeu Fabra University, 08003 Barcelona, Spain.; Medel-Lacruz B; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Medicine and Life Sciences, Pompeu Fabra University, 08003 Barcelona, Spain.; Torrens-Fontanals M; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Medicine and Life Sciences, Pompeu Fabra University, 08003 Barcelona, Spain.; Peralta-García A; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Medicine and Life Sciences, Pompeu Fabra University, 08003 Barcelona, Spain.; Selent J; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute, Department of Medicine and Life Sciences, Pompeu Fabra University, 08003 Barcelona, Spain.

Publisher: MDPI Country of Publication: Switzerland NLM ID: 101092791 Publication Model: Electronic Cited Medium: Internet ISSN: 1422-0067 (Electronic) Linking ISSN: 14220067 NLM ISO Abbreviation: Int J Mol Sci Subsets: MEDLINE

Peralta-Garcia A; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences, Hospital del Mar Medical Research Institute (IMIM), Pompeu Fabra University (UPF), 08003 Barcelona, Spain.; Torrens-Fontanals M; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences, Hospital del Mar Medical Research Institute (IMIM), Pompeu Fabra University (UPF), 08003 Barcelona, Spain.; Stepniewski TM; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences, Hospital del Mar Medical Research Institute (IMIM), Pompeu Fabra University (UPF), 08003 Barcelona, Spain.; InterAx Biotech AG, PARK InnovAARE, 5234 Villigen, Switzerland.; Grau-Expósito J; Infectious Diseases Department, Vall d'Hebron Institut de Recerca (VHIR), Vall d'Hebron Barcelona Hospital Campus, Vall d'Hebron Hospital Universitari, 08035 Barcelona, Spain.; Perea D; Infectious Diseases Department, Vall d'Hebron Institut de Recerca (VHIR), Vall d'Hebron Barcelona Hospital Campus, Vall d'Hebron Hospital Universitari, 08035 Barcelona, Spain.; Ayinampudi V; InterAx Biotech AG, PARK InnovAARE, 5234 Villigen, Switzerland.; Waldhoer M; InterAx Biotech AG, PARK InnovAARE, 5234 Villigen, Switzerland.; Zimmermann M; InterAx Biotech AG, PARK InnovAARE, 5234 Villigen, Switzerland.; Buzón MJ; Infectious Diseases Department, Vall d'Hebron Institut de Recerca (VHIR), Vall d'Hebron Barcelona Hospital Campus, Vall d'Hebron Hospital Universitari, 08035 Barcelona, Spain.; Genescà M; Infectious Diseases Department, Vall d'Hebron Institut de Recerca (VHIR), Vall d'Hebron Barcelona Hospital Campus, Vall d'Hebron Hospital Universitari, 08035 Barcelona, Spain.; Selent J; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences, Hospital del Mar Medical Research Institute (IMIM), Pompeu Fabra University (UPF), 08003 Barcelona, Spain.

Publisher: MDPI Country of Publication: Switzerland NLM ID: 101092791 Publication Model: Electronic Cited Medium: Internet ISSN: 1422-0067 (Electronic) Linking ISSN: 14220067 NLM ISO Abbreviation: Int J Mol Sci Subsets: MEDLINE

Ramírez-Anguita JM; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences of Pompeu Fabra University (UPF)-Hospital del Mar Medical Research Institute (IMIM), Barcelona, Spain.; Rodríguez-Espigares I; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences of Pompeu Fabra University (UPF)-Hospital del Mar Medical Research Institute (IMIM), Barcelona, Spain.; Guixà-González R; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences of Pompeu Fabra University (UPF)-Hospital del Mar Medical Research Institute (IMIM), Barcelona, Spain.; Institut für Medizinische Physik und Biophysik, Charité, Berlin, Germany.; Bruno A; Department of Pharmacy, Università degli studi di Parma, Italy, Parma.; Torrens-Fontanals M; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences of Pompeu Fabra University (UPF)-Hospital del Mar Medical Research Institute (IMIM), Barcelona, Spain.; Varela-Rial A; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences of Pompeu Fabra University (UPF)-Hospital del Mar Medical Research Institute (IMIM), Barcelona, Spain.; Selent J; Research Programme on Biomedical Informatics (GRIB), Department of Experimental and Health Sciences of Pompeu Fabra University (UPF)-Hospital del Mar Medical Research Institute (IMIM), Barcelona, Spain.

Publisher: Wiley-Blackwell Country of Publication: United States NLM ID: 8609465 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1470-8744 (Electronic) Linking ISSN: 08854513 NLM ISO Abbreviation: Biotechnol Appl Biochem Subsets: MEDLINE

Rodríguez-Espigares I; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Torrens-Fontanals M; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Tiemann JKS; Institute of Medical Physics and Biophysics, Charite University Medicine Berlin, Berlin, Germany.; Institute of Medical Physics and Biophysics, Medical University Leipzig, Leipzig, Sachsen, Germany.; Aranda-García D; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Ramírez-Anguita JM; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Stepniewski TM; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Worp N; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Varela-Rial A; Computational Science Laboratory, Universitat Pompeu Fabra, Barcelona Biomedical Research Park, Barcelona, Spain.; Acellera, Barcelona, Spain.; Morales-Pastor A; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Medel-Lacruz B; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Pándy-Szekeres G; Department of Drug Design and Pharmacology, University of Copenhagen, Copenhagen, Denmark.; Mayol E; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Giorgino T; Biophysics Institute, National Research Council of Italy, Milan, Italy.; Department of Biosciences, University of Milan, Milan, Italy.; Carlsson J; Science for Life Laboratory, Department of Cell and Molecular Biology, Uppsala University, Uppsala, Sweden.; Deupi X; Laboratory of Biomolecular Research, Paul Scherrer Institute (PSI), Villigen PSI, Switzerland.; Condensed Matter Theory Group, PSI, Villigen PSI, Switzerland.; Filipek S; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, Warsaw, Poland.; Filizola M; Department of Pharmacological Sciences, Icahn School of Medicine at Mount Sinai, New York, NY, USA.; Gómez-Tamayo JC; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Gonzalez A; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Gutiérrez-de-Terán H; Department of Cell and Molecular Biology, Uppsala University, Biomedical Center, Uppsala, Sweden.; Jiménez-Rosés M; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Jespers W; Department of Cell and Molecular Biology, Uppsala University, Biomedical Center, Uppsala, Sweden.; Kapla J; Science for Life Laboratory, Department of Cell and Molecular Biology, Uppsala University, Uppsala, Sweden.; Khelashvili G; Department of Physiology and Biophysics, Weill Cornell Medical College of Cornell University, New York, NY, USA.; Institute for Computational Biomedicine, Weill Cornell Medical College of Cornell University, New York, NY, USA.; Kolb P; Department of Pharmaceutical Chemistry, Philipps-University Marburg, Marburg, Germany.; Latek D; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, Warsaw, Poland.; Marti-Solano M; Department of Pharmaceutical Chemistry, Philipps-University Marburg, Marburg, Germany.; MRC Laboratory of Molecular Biology, Cambridge, UK.; Matricon P; Science for Life Laboratory, Department of Cell and Molecular Biology, Uppsala University, Uppsala, Sweden.; Matsoukas MT; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Department of Pharmacy, University of Patras, Patras, Greece.; Miszta P; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, Warsaw, Poland.; Olivella M; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Perez-Benito L; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Provasi D; Department of Pharmacological Sciences, Icahn School of Medicine at Mount Sinai, New York, NY, USA.; Ríos S; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; R Torrecillas I; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Sallander J; Department of Cell and Molecular Biology, Uppsala University, Biomedical Center, Uppsala, Sweden.; Sztyler A; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, Warsaw, Poland.; Vasile S; Department of Cell and Molecular Biology, Uppsala University, Biomedical Center, Uppsala, Sweden.; Weinstein H; Department of Physiology and Biophysics, Weill Cornell Medical College of Cornell University, New York, NY, USA.; Institute for Computational Biomedicine, Weill Cornell Medical College of Cornell University, New York, NY, USA.; Zachariae U; Computational Biology, School of Life Sciences, University of Dundee, Dundee, UK.; Physics, School of Science and Engineering, University of Dundee, Dundee, UK.; Hildebrand PW; Institute of Medical Physics and Biophysics, Charite University Medicine Berlin, Berlin, Germany.; Institute of Medical Physics and Biophysics, Medical University Leipzig, Leipzig, Sachsen, Germany.; Berlin Institute of Health, Berlin, Germany.; De Fabritiis G; Computational Science Laboratory, Universitat Pompeu Fabra, Barcelona Biomedical Research Park, Barcelona, Spain.; Acellera, Barcelona, Spain.; Sanz F; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Gloriam DE; Department of Drug Design and Pharmacology, University of Copenhagen, Copenhagen, Denmark.; Cordomi A; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Guixà-González R; Laboratory of Biomolecular Research, Paul Scherrer Institute (PSI), Villigen PSI, Switzerland. ramon.guixa@psi.ch.; Condensed Matter Theory Group, PSI, Villigen PSI, Switzerland. ramon.guixa@psi.ch.; Selent J; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain. jana.selent@upf.edu.

Publisher: Nature Pub. Group Country of Publication: United States NLM ID: 101215604 Publication Model: Print Cited Medium: Internet ISSN: 1548-7105 (Electronic) Linking ISSN: 15487091 NLM ISO Abbreviation: Nat Methods Subsets: MEDLINE; PubMed not MEDLINE

Rodríguez-Espigares I; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Torrens-Fontanals M; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Tiemann JKS; Institute of Medical Physics and Biophysics, Charite University Medicine Berlin, Berlin, Germany.; Institute of Medical Physics and Biophysics, Medical University Leipzig, Leipzig, Sachsen, Germany.; Aranda-García D; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Ramírez-Anguita JM; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Stepniewski TM; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Worp N; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Varela-Rial A; Computational Science Laboratory, Universitat Pompeu Fabra, Barcelona Biomedical Research Park, Barcelona, Spain.; Acellera, Barcelona, Spain.; Morales-Pastor A; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Medel-Lacruz B; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Pándy-Szekeres G; Department of Drug Design and Pharmacology, University of Copenhagen, Copenhagen, Denmark.; Mayol E; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Giorgino T; Biophysics Institute, National Research Council of Italy, Milan, Italy.; Department of Biosciences, University of Milan, Milan, Italy.; Carlsson J; Science for Life Laboratory, Department of Cell and Molecular Biology, Uppsala University, Uppsala, Sweden.; Deupi X; Laboratory of Biomolecular Research, Paul Scherrer Institute (PSI), Villigen PSI, Switzerland.; Condensed Matter Theory Group, PSI, Villigen PSI, Switzerland.; Filipek S; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, Warsaw, Poland.; Filizola M; Department of Pharmacological Sciences, Icahn School of Medicine at Mount Sinai, New York, NY, USA.; Gómez-Tamayo JC; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Gonzalez A; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Gutiérrez-de-Terán H; Department of Cell and Molecular Biology, Uppsala University, Biomedical Center, Uppsala, Sweden.; Jiménez-Rosés M; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Jespers W; Department of Cell and Molecular Biology, Uppsala University, Biomedical Center, Uppsala, Sweden.; Kapla J; Science for Life Laboratory, Department of Cell and Molecular Biology, Uppsala University, Uppsala, Sweden.; Khelashvili G; Department of Physiology and Biophysics, Weill Cornell Medical College of Cornell University, New York, NY, USA.; Institute for Computational Biomedicine, Weill Cornell Medical College of Cornell University, New York, NY, USA.; Kolb P; Department of Pharmaceutical Chemistry, Philipps-University Marburg, Marburg, Germany.; Latek D; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, Warsaw, Poland.; Marti-Solano M; Department of Pharmaceutical Chemistry, Philipps-University Marburg, Marburg, Germany.; MRC Laboratory of Molecular Biology, Cambridge, UK.; Matricon P; Science for Life Laboratory, Department of Cell and Molecular Biology, Uppsala University, Uppsala, Sweden.; Matsoukas MT; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Department of Pharmacy, University of Patras, Patras, Greece.; Miszta P; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, Warsaw, Poland.; Olivella M; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Perez-Benito L; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Provasi D; Department of Pharmacological Sciences, Icahn School of Medicine at Mount Sinai, New York, NY, USA.; Ríos S; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; R Torrecillas I; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Sallander J; Department of Cell and Molecular Biology, Uppsala University, Biomedical Center, Uppsala, Sweden.; Sztyler A; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, Warsaw, Poland.; Vasile S; Department of Cell and Molecular Biology, Uppsala University, Biomedical Center, Uppsala, Sweden.; Weinstein H; Department of Physiology and Biophysics, Weill Cornell Medical College of Cornell University, New York, NY, USA.; Institute for Computational Biomedicine, Weill Cornell Medical College of Cornell University, New York, NY, USA.; Zachariae U; Computational Biology, School of Life Sciences, University of Dundee, Dundee, UK.; Physics, School of Science and Engineering, University of Dundee, Dundee, UK.; Hildebrand PW; Institute of Medical Physics and Biophysics, Charite University Medicine Berlin, Berlin, Germany.; Institute of Medical Physics and Biophysics, Medical University Leipzig, Leipzig, Sachsen, Germany.; Berlin Institute of Health, Berlin, Germany.; De Fabritiis G; Computational Science Laboratory, Universitat Pompeu Fabra, Barcelona Biomedical Research Park, Barcelona, Spain.; Acellera, Barcelona, Spain.; Sanz F; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain.; Gloriam DE; Department of Drug Design and Pharmacology, University of Copenhagen, Copenhagen, Denmark.; Cordomi A; Laboratori de Medicina Computacional, Unitat de Bioestadistica, Facultat de Medicina, Universitat Autònoma de Barcelona, Bellaterra, Spain.; Guixà-González R; Laboratory of Biomolecular Research, Paul Scherrer Institute (PSI), Villigen PSI, Switzerland. ramon.guixa@psi.ch.; Condensed Matter Theory Group, PSI, Villigen PSI, Switzerland. ramon.guixa@psi.ch.; Selent J; Research Programme on Biomedical Informatics, Hospital del Mar Medical Research Institute-Department of Experimental and Health Sciences, Pompeu Fabra University, Barcelona, Spain. jana.selent@upf.edu.

Publisher: Nature Pub. Group Country of Publication: United States NLM ID: 101215604 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1548-7105 (Electronic) Linking ISSN: 15487091 NLM ISO Abbreviation: Nat Methods Subsets: MEDLINE

Torrens-Fontanals M; Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM)-Department of Experimental and Health Sciences, Pompeu Fabra University (UPF), 08003 Barcelona, Spain.; Stepniewski TM; Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM)-Department of Experimental and Health Sciences, Pompeu Fabra University (UPF), 08003 Barcelona, Spain.; InterAx Biotech AG, PARK innovAARE, 5234 Villigen, Switzerland.; Faculty of Chemistry, Biological and Chemical Research Centre, University of Warsaw, 02-093 Warsaw, Poland.; Aranda-García D; Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM)-Department of Experimental and Health Sciences, Pompeu Fabra University (UPF), 08003 Barcelona, Spain.; Morales-Pastor A; Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM)-Department of Experimental and Health Sciences, Pompeu Fabra University (UPF), 08003 Barcelona, Spain.; Medel-Lacruz B; Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM)-Department of Experimental and Health Sciences, Pompeu Fabra University (UPF), 08003 Barcelona, Spain.; Selent J; Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM)-Department of Experimental and Health Sciences, Pompeu Fabra University (UPF), 08003 Barcelona, Spain.

Publisher: MDPI Country of Publication: Switzerland NLM ID: 101092791 Publication Model: Electronic Cited Medium: Internet ISSN: 1422-0067 (Electronic) Linking ISSN: 14220067 NLM ISO Abbreviation: Int J Mol Sci Subsets: MEDLINE

Stepniewski TM; GPCR Drug Discovery Lab, Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM) - Department of Experimental and Health Sciences of Pompeu Fabra University (UPF), Barcelona, Spain.; Torrens-Fontanals M; GPCR Drug Discovery Lab, Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM) - Department of Experimental and Health Sciences of Pompeu Fabra University (UPF), Barcelona, Spain.; Rodríguez-Espigares I; GPCR Drug Discovery Lab, Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM) - Department of Experimental and Health Sciences of Pompeu Fabra University (UPF), Barcelona, Spain.; Giorgino T; Consiglio Nazionale delle Ricerche, Istituto di Neuroscienze, Corso Stati Uniti 4, 35127 Padova, Italy.; Primdahl KG; Department of Pharmaceutical Chemistry, School of Pharmacy, University of Oslo, P.O. Box 1068, Blindern N-0316, Oslo, Norway.; Vik A; Department of Pharmaceutical Chemistry, School of Pharmacy, University of Oslo, P.O. Box 1068, Blindern N-0316, Oslo, Norway.; Stenstrøm Y; Faculty of Chemistry, Biology and Food Science, Norwegian University of Life Sciences, P.O. Box 5003, N-1432 Ås, Norway.; Selent J; GPCR Drug Discovery Lab, Research Programme on Biomedical Informatics (GRIB), Hospital del Mar Medical Research Institute (IMIM) - Department of Experimental and Health Sciences of Pompeu Fabra University (UPF), Barcelona, Spain. Electronic address: jana.selent@upf.edu.; Hansen TV; Department of Pharmaceutical Chemistry, School of Pharmacy, University of Oslo, P.O. Box 1068, Blindern N-0316, Oslo, Norway; Faculty of Chemistry, Biology and Food Science, Norwegian University of Life Sciences, P.O. Box 5003, N-1432 Ås, Norway. Electronic address: t.v.hansen@farmasi.uio.no.

Publisher: Elsevier Science Country of Publication: England NLM ID: 9413298 Publication Model: Print-Electronic Cited Medium: Internet ISSN: 1464-3391 (Electronic) Linking ISSN: 09680896 NLM ISO Abbreviation: Bioorg Med Chem Subsets: MEDLINE

Aranda-Garcia, D.; Torrens-Fontanals, M.; Medel-Lacruz, B.; Lopez-Balastegui, M.; Peralta-García, A.; Dieguez-Eceolaza, M.; Morales-Pastor, A.; Sotillo-Núñez, D.; Abbondandolo, D.; Stępniewski, T.M.; Selent, J.

In: Comprehensive Pharmacology, Seven Volume Set. (Comprehensive Pharmacology, Seven Volume Set, 1 January 2022, 2:V2:115-V2:134)

Torrens-Fontanals, M.; Stepniewski, T.M.; Rodríguez-Espigares, I.; Selent, J.

In: Biomolecular Simulations in Structure-Based Drug Discovery. (Biomolecular Simulations in Structure-Based Drug Discovery, 1 January 2018, :205-223)