Subjects -> COMPUTER SCIENCE (Total: 2313 journals)
    - ANIMATION AND SIMULATION (33 journals)
    - ARTIFICIAL INTELLIGENCE (133 journals)
    - AUTOMATION AND ROBOTICS (116 journals)
    - CLOUD COMPUTING AND NETWORKS (75 journals)
    - COMPUTER ARCHITECTURE (11 journals)
    - COMPUTER ENGINEERING (12 journals)
    - COMPUTER GAMES (23 journals)
    - COMPUTER PROGRAMMING (25 journals)
    - COMPUTER SCIENCE (1305 journals)
    - COMPUTER SECURITY (59 journals)
    - DATA BASE MANAGEMENT (21 journals)
    - DATA MINING (50 journals)
    - E-BUSINESS (21 journals)
    - E-LEARNING (30 journals)
    - ELECTRONIC DATA PROCESSING (23 journals)
    - IMAGE AND VIDEO PROCESSING (42 journals)
    - INFORMATION SYSTEMS (109 journals)
    - INTERNET (111 journals)
    - SOCIAL WEB (61 journals)
    - SOFTWARE (43 journals)
    - THEORY OF COMPUTING (10 journals)

COMPUTER SCIENCE (1305 journals)            First | 1 2 3 4 5 6 7 | Last

Showing 601 - 800 of 872 Journals sorted alphabetically
International Journal of Digital Enterprise Technology     Hybrid Journal   (Followers: 1)
International Journal of Digital Literacy and Digital Competence     Full-text available via subscription   (Followers: 6)
International Journal of Digital Signals and Smart Systems     Hybrid Journal   (Followers: 4)
International Journal of Education and Development using Information and Communication Technology     Open Access   (Followers: 9)
International Journal of Electrical and Computer Engineering     Open Access   (Followers: 8)
International Journal of Electronic Banking     Hybrid Journal   (Followers: 3)
International Journal of Electronic Business     Hybrid Journal   (Followers: 2)
International Journal of Electronic Commerce     Full-text available via subscription   (Followers: 10)
International Journal of Electronic Government Research     Full-text available via subscription   (Followers: 3)
International Journal of Embedded and Real-Time Communication Systems     Full-text available via subscription   (Followers: 9)
International Journal of Engineering and Manufacturing     Open Access   (Followers: 3)
International Journal of Engineering Science     Hybrid Journal   (Followers: 5)
International Journal of Entertainment Technology and Management     Hybrid Journal   (Followers: 1)
International Journal of Experimental Design and Process Optimisation     Hybrid Journal   (Followers: 5)
International Journal of Foundations of Computer Science     Hybrid Journal   (Followers: 3)
International Journal of Fuzzy Computation and Modelling     Hybrid Journal   (Followers: 2)
International Journal of Fuzzy System Applications     Full-text available via subscription   (Followers: 3)
International Journal of General Systems     Hybrid Journal   (Followers: 1)
International Journal of Granular Computing, Rough Sets and Intelligent Systems     Hybrid Journal   (Followers: 1)
International Journal of Green Computing     Full-text available via subscription  
International Journal of Grid and High Performance Computing     Full-text available via subscription   (Followers: 2)
International Journal of Grid and Utility Computing     Hybrid Journal  
International Journal of Handheld Computing Research     Full-text available via subscription  
International Journal of Heritage in the Digital Era     Full-text available via subscription   (Followers: 7)
International Journal of High Performance Computing and Networking     Hybrid Journal   (Followers: 4)
International Journal of High Performance Computing Applications     Hybrid Journal   (Followers: 4)
International Journal of High Performance Systems Architecture     Hybrid Journal   (Followers: 6)
International Journal of Human Capital and Information Technology Professionals     Full-text available via subscription   (Followers: 3)
International Journal of Human-Computer Interaction     Hybrid Journal   (Followers: 22)
International Journal of Human-Computer Studies     Hybrid Journal   (Followers: 20)
International Journal of Humanitarian Technology     Hybrid Journal   (Followers: 1)
International Journal of Humanities and Arts Computing     Hybrid Journal   (Followers: 11)
International Journal of Hybrid Intelligence     Hybrid Journal   (Followers: 1)
International Journal of ICT Research and Development in Africa     Full-text available via subscription   (Followers: 4)
International Journal of Imaging Systems and Technology     Hybrid Journal   (Followers: 1)
International Journal of Impact Engineering     Hybrid Journal   (Followers: 9)
International Journal of Industrial and Systems Engineering     Hybrid Journal   (Followers: 7)
International Journal of Industrial Electronics and Drives     Hybrid Journal   (Followers: 3)
International Journal of Information and Coding Theory     Hybrid Journal   (Followers: 6)
International Journal of Information and Communication Technology Education     Full-text available via subscription   (Followers: 13)
International Journal of Information Communication Technologies and Human Development     Full-text available via subscription   (Followers: 4)
International Journal of Information Quality     Hybrid Journal   (Followers: 3)
International Journal of Information Retrieval Research     Full-text available via subscription   (Followers: 28)
International Journal of Information Science and Management     Open Access   (Followers: 5)
International Journal of Information Science and Technology     Open Access  
International Journal of Information Systems and Management     Hybrid Journal   (Followers: 2)
International Journal of Information Systems and Project Management     Free   (Followers: 12)
International Journal of Information Systems and Software Engineering for Big Companies     Open Access   (Followers: 2)
International Journal of Information Technology and Computer Science     Open Access   (Followers: 3)
International Journal of Information Technology and Web Engineering     Hybrid Journal   (Followers: 2)
International Journal of Information Technology Project Management     Full-text available via subscription   (Followers: 9)
International Journal of Information Technology, Communications and Convergence     Hybrid Journal   (Followers: 14)
International Journal of Innovation in the Digital Economy     Full-text available via subscription   (Followers: 5)
International Journal of Innovative Computing and Applications     Hybrid Journal   (Followers: 3)
International Journal of Innovative Technology and Research     Open Access   (Followers: 1)
International Journal of Intelligence and Sustainable Computing     Hybrid Journal  
International Journal of Intelligence Science     Open Access   (Followers: 3)
International Journal of Intelligent Engineering Informatics     Hybrid Journal  
International Journal of Intelligent Enterprise     Hybrid Journal   (Followers: 1)
International Journal of Intelligent Information and Database Systems     Hybrid Journal   (Followers: 3)
International Journal of Intelligent Internet of Things Computing     Hybrid Journal   (Followers: 2)
International Journal of Intelligent Networks     Open Access  
International Journal of Intelligent Systems Technologies and Applications     Hybrid Journal   (Followers: 2)
International Journal of Intercultural Relations     Hybrid Journal   (Followers: 16)
International Journal of IT Standards and Standardization Research     Full-text available via subscription  
International Journal of IT/Business Alignment and Governance     Full-text available via subscription  
International Journal of Knowledge and Systems Science     Full-text available via subscription   (Followers: 1)
International Journal of Knowledge Engineering and Soft Data Paradigms     Hybrid Journal   (Followers: 1)
International Journal of Knowledge Society Research     Full-text available via subscription  
International Journal of Leadership in Education: Theory and Practice     Hybrid Journal   (Followers: 23)
International Journal of Logistics Research and Applications : A Leading Journal of Supply Chain Management     Hybrid Journal   (Followers: 16)
International Journal of Management & Information Technology     Open Access   (Followers: 2)
International Journal of Management Innovation Systems     Open Access  
International Journal of Mathematical Modelling & Computations     Open Access   (Followers: 3)
International Journal of Mathematical Sciences and Computing     Open Access  
International Journal of Mathematics & Computation     Full-text available via subscription  
International Journal of Mathematics in Operational Research     Hybrid Journal   (Followers: 2)
International Journal of Medical Engineering and Informatics     Hybrid Journal   (Followers: 4)
International Journal of Medical Informatics     Hybrid Journal   (Followers: 10)
International Journal of Metadata, Semantics and Ontologies     Hybrid Journal   (Followers: 9)
International Journal of Metaheuristics     Hybrid Journal   (Followers: 1)
International Journal of Mobile Communications     Hybrid Journal   (Followers: 8)
International Journal of Mobile Computing and Multimedia Communications     Full-text available via subscription   (Followers: 2)
International Journal of Mobile Network Design and Innovation     Hybrid Journal   (Followers: 1)
International Journal of Modeling, Simulation, and Scientific Computing     Hybrid Journal   (Followers: 3)
International Journal of Modelling, Identification and Control     Hybrid Journal   (Followers: 1)
International Journal of Modern Education and Computer Science     Open Access   (Followers: 2)
International Journal of Multimedia Data Engineering and Management     Full-text available via subscription   (Followers: 2)
International Journal of Multimedia Information Retrieval     Partially Free   (Followers: 8)
International Journal of Nanotechnology and Molecular Computation     Full-text available via subscription   (Followers: 4)
International Journal of Natural Computing Research     Hybrid Journal  
International Journal of Neural Systems     Hybrid Journal   (Followers: 4)
International Journal of Online Marketing     Full-text available via subscription   (Followers: 5)
International Journal of Organizational and Collective Intelligence     Hybrid Journal   (Followers: 1)
International Journal of Parallel, Emergent and Distributed Systems     Hybrid Journal   (Followers: 3)
International Journal of Pattern Recognition and Artificial Intelligence     Hybrid Journal   (Followers: 12)
International Journal of Performance Arts and Digital Media     Hybrid Journal   (Followers: 12)
International Journal of Pervasive Computing and Communications     Hybrid Journal   (Followers: 3)
International Journal of Polymer Science     Open Access   (Followers: 25)
International Journal of Process Systems Engineering     Hybrid Journal   (Followers: 1)
International Journal of Quantum Information     Hybrid Journal   (Followers: 6)
International Journal of Reasoning-based Intelligent Systems     Hybrid Journal  
International Journal of Reconfigurable and Embedded Systems     Open Access   (Followers: 6)
International Journal of Reconfigurable Computing     Open Access  
International Journal of Refractory Metals and Hard Materials     Hybrid Journal   (Followers: 5)
International Journal of Reliability, Quality and Safety Engineering     Hybrid Journal   (Followers: 14)
International Journal of Reliable and Quality E-Healthcare     Full-text available via subscription   (Followers: 2)
International Journal of Research Studies in Computing     Open Access  
International Journal of RF and Microwave Computer-Aided Engineering     Hybrid Journal   (Followers: 26)
International Journal of Sediment Research     Full-text available via subscription   (Followers: 2)
International Journal of Sensor Networks     Hybrid Journal   (Followers: 2)
International Journal of Service and Computing Oriented Manufacturing     Hybrid Journal   (Followers: 2)
International Journal of Shape Modeling     Hybrid Journal   (Followers: 1)
International Journal of Signs and Semiotic Systems     Full-text available via subscription  
International Journal of Smart Grid and Green Communications     Hybrid Journal   (Followers: 2)
International Journal of Social and Organizational Dynamics in IT     Full-text available via subscription   (Followers: 1)
International Journal of Sociotechnology and Knowledge Development     Full-text available via subscription   (Followers: 1)
International Journal of Soft Computing and Networking     Hybrid Journal   (Followers: 2)
International Journal of Soft Computing and Software Engineering     Open Access   (Followers: 13)
International Journal of Software Engineering and Knowledge Engineering     Hybrid Journal   (Followers: 6)
International Journal of Spatio-Temporal Data Science     Hybrid Journal  
International Journal of Speech Technology     Hybrid Journal   (Followers: 7)
International Journal of Strategic Change Management     Hybrid Journal   (Followers: 7)
International Journal of Strategic Communication     Hybrid Journal   (Followers: 5)
International Journal of Strategic Information Technology and Applications     Full-text available via subscription   (Followers: 1)
International Journal of Stress Management     Full-text available via subscription   (Followers: 6)
International Journal of Student Project Reporting     Hybrid Journal   (Followers: 4)
International Journal of Swarm Intelligence     Hybrid Journal   (Followers: 2)
International Journal of Swarm Intelligence Research     Full-text available via subscription   (Followers: 3)
International Journal of System Dynamics Applications     Full-text available via subscription  
International Journal of Systems Science     Hybrid Journal   (Followers: 2)
International Journal of Systems Science : Operations & Logistics     Hybrid Journal  
International Journal of Systems, Control and Communications     Hybrid Journal   (Followers: 6)
International Journal of Technoethics     Full-text available via subscription   (Followers: 2)
International Journal of Technology and Educational Marketing     Full-text available via subscription   (Followers: 2)
International Journal of Technology and Human Interaction     Full-text available via subscription   (Followers: 2)
International Journal of Technology Diffusion     Full-text available via subscription   (Followers: 1)
International Journal of Technology Marketing     Hybrid Journal   (Followers: 3)
International Journal of Telecommunications & Emerging Technologies     Full-text available via subscription   (Followers: 1)
International Journal of the Digital Human     Hybrid Journal   (Followers: 2)
International Journal of Trust Management in Computing and Communications     Hybrid Journal   (Followers: 1)
International Journal of Ultra Wideband Communications and Systems     Hybrid Journal  
International Journal of Virtual Reality     Open Access   (Followers: 1)
International Journal of Virtual Technology and Multimedia     Hybrid Journal   (Followers: 2)
International Journal of Web Services Research     Full-text available via subscription  
International Journal of Wireless and Microwave Technologies     Open Access   (Followers: 12)
International Journal of Wireless Information Networks     Hybrid Journal   (Followers: 2)
International Journal on Advances in ICT for Emerging Regions (ICTer)     Open Access   (Followers: 2)
International Journal on Artificial Intelligence Tools     Hybrid Journal   (Followers: 9)
International Journal on Digital Libraries     Hybrid Journal   (Followers: 544)
International Journal on Document Analysis and Recognition (IJDAR)     Hybrid Journal   (Followers: 2)
International Journal on Smart Sensing and Intelligent Systems     Open Access  
International Journal on Software Tools for Technology Transfer (STTT)     Hybrid Journal   (Followers: 4)
International Review of Law, Computers & Technology     Hybrid Journal   (Followers: 3)
International Review of Research in Open and Distance Learning     Open Access   (Followers: 24)
International Transaction of Electrical and Computer Engineers System     Open Access   (Followers: 2)
Internet of Things     Hybrid Journal   (Followers: 2)
Internet of Things and Cyber-Physical Systems     Open Access   (Followers: 1)
Internet Technology Letters     Hybrid Journal  
IoT     Open Access  
IPSJ Transactions on Computer Vision and Applications     Open Access   (Followers: 1)
Iran Journal of Computer Science     Hybrid Journal  
ISPRS Open Journal of Photogrammetry and Remote Sensing     Open Access   (Followers: 3)
ISSS Journal of Micro and Smart Systems     Hybrid Journal   (Followers: 3)
Issues in Informing Science and Information Technology     Open Access   (Followers: 2)
IT Journal Research and Development     Open Access  
ITM Web of Conferences     Open Access  
ITNOW     Hybrid Journal   (Followers: 1)
J-ENSITEC : Journal Of Engineering and Sustainable Technology     Open Access   (Followers: 4)
JISTEM : Journal of Information Systems and Technology Management     Open Access   (Followers: 6)
JMIR mHealth and uHealth     Open Access   (Followers: 3)
Johnson Matthey Technology Review     Open Access  
Jornal Brasileiro de TeleSSaúde     Open Access  
Journal of Computer Science & Systems Biology     Open Access   (Followers: 3)
Journal of 3D Printing in Medicine     Hybrid Journal  
Journal of Advanced Computer Science & Technology     Open Access   (Followers: 3)
Journal of Advances in Information Systems and Technology     Open Access  
Journal of Advances in Mathematics and Computer Science     Open Access  
Journal of Aggression Maltreatment & Trauma     Hybrid Journal   (Followers: 5)
Journal of Algorithms & Computational Technology     Open Access  
Journal of Altmetrics     Open Access   (Followers: 7)
Journal of Ambient Intelligence and Humanized Computing     Hybrid Journal   (Followers: 1)
Journal of Applied & Computational Mathematics     Open Access  
Journal of Applied and Computational Topology     Hybrid Journal  
Journal of Applied Bioinformatics & Computational Biology     Hybrid Journal   (Followers: 4)
Journal of Applied Communication Research     Hybrid Journal   (Followers: 10)
Journal of Applied Informatics and Technology     Open Access  
Journal of Applied Intelligent System     Open Access  
Journal of Approximation Theory     Hybrid Journal   (Followers: 1)
Journal of Artificial Intelligence     Open Access   (Followers: 18)
Journal of Automated Reasoning     Hybrid Journal  
Journal of Automation and Control     Open Access   (Followers: 9)
Journal of Banking and Financial Technology     Hybrid Journal   (Followers: 1)
Journal of Big Data     Open Access   (Followers: 16)
Journal of Bioinformatics and Computational Biology     Hybrid Journal   (Followers: 19)
Journal of Biomedical Informatics     Partially Free   (Followers: 9)
Journal of Cases on Information Technology     Full-text available via subscription   (Followers: 3)
Journal of Chemical Information and Modeling     Hybrid Journal   (Followers: 18)
Journal of Chemical Theory and Computation     Hybrid Journal   (Followers: 21)
Journal of Circuits, Systems, and Computers     Hybrid Journal   (Followers: 4)

  First | 1 2 3 4 5 6 7 | Last

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Journal Cover
Journal of Chemical Information and Modeling
Journal Prestige (SJR): 1.349
Citation Impact (citeScore): 4
Number of Followers: 18  
 
  Hybrid Journal Hybrid journal (It can contain Open Access articles)
ISSN (Print) 1549-9596 - ISSN (Online) 1549-960X
Published by ACS Homepage  [69 journals]
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           Property-Oriented Chromophores Based on Explainable Deep Learning Optical
           Spectroscopy

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      Authors: Joonyoung F. Joung; Minhi Han, Minseok Jeong, Sungnam Park
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00173
      PubDate: Wed, 27 Apr 2022 04:00:00 GMT
       
  • Staphylococcus+aureus&rft.title=Journal+of+Chemical+Information+and+Modeling&rft.issn=1549-9596&rft.date=2022&rft.volume=&rft.aulast=Dalal&rft.aufirst=Vikram&rft.au=Vikram+Dalal&rft.au=Dasantila+Golemi-Kotra,++Pravindra+Kumar">[ASAP] Quantum Mechanics/Molecular Mechanics Studies on the Catalytic
           Mechanism of a Novel Esterase (FmtA) of Staphylococcus aureus

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      Authors: Vikram Dalal; Dasantila Golemi-Kotra, Pravindra Kumar
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00057
      PubDate: Wed, 27 Apr 2022 04:00:00 GMT
       
  • [ASAP] Recognition and Binding of RsmE to an AGGAC Motif of RsmZ: Insights
           from Molecular Dynamics Simulations

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      Authors: Agustín Ormazábal; Gustavo Pierdominici-Sottile, Juliana Palma
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00037
      PubDate: Tue, 26 Apr 2022 04:00:00 GMT
       
  • In+Silico+Design+Strategies&rft.title=Journal+of+Chemical+Information+and+Modeling&rft.issn=1549-9596&rft.date=2022&rft.volume=&rft.aulast=Cheshmazar&rft.aufirst=Narges&rft.au=Narges+Cheshmazar&rft.au=Salar+Hemmati,++Maryam+Hamzeh-Mivehroud,++Babak+Sokouti,++Matthes+Zessin∞,++Mike+Schutkowski,++Wolfgang+Sippl,++Hojjatollah+Nozad+Charoudeh,++Siavoush+Dastmalchi">[ASAP] Development of New Inhibitors of HDAC1–3 Enzymes Aided by In
           Silico Design Strategies

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      Authors: Narges Cheshmazar; Salar Hemmati, Maryam Hamzeh-Mivehroud, Babak Sokouti, Matthes Zessin∞, Mike Schutkowski, Wolfgang Sippl, Hojjatollah Nozad Charoudeh, Siavoush Dastmalchi
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01557
      PubDate: Mon, 25 Apr 2022 04:00:00 GMT
       
  • [ASAP] Expanding the Accessible Chemical Space of SIRT2 Inhibitors through
           Exploration of Binding Pocket Dynamics

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      Authors: Nemanja Djokovic; Dusan Ruzic, Minna Rahnasto-Rilla, Tatjana Srdic-Rajic, Maija Lahtela-Kakkonen, Katarina Nikolic
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00241
      PubDate: Mon, 25 Apr 2022 04:00:00 GMT
       
  • [ASAP] AA-Score: a New Scoring Function Based on Amino Acid-Specific
           Interaction for Molecular Docking

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      Authors: Xiaolin Pan; Hao Wang, Yueqing Zhang, Xingyu Wang, Cuiyu Li, Changge Ji, John Z. H. Zhang
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01537
      PubDate: Fri, 22 Apr 2022 04:00:00 GMT
       
  • [ASAP] Performance Analysis of CP2K Code for Ab Initio Molecular Dynamics
           on CPUs and GPUs

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      Authors: Dewi Yokelson; Nikolay V. Tkachenko, Robert Robey, Ying Wai Li, Pavel A. Dub
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01538
      PubDate: Fri, 22 Apr 2022 04:00:00 GMT
       
  • Metallohydrolase:+Peptide+and+Phosphoester+Hydrolyses&rft.title=Journal+of+Chemical+Information+and+Modeling&rft.issn=1549-9596&rft.date=2022&rft.volume=&rft.aulast=Serafim&rft.aufirst=Leonardo&rft.au=Leonardo+F.+Serafim&rft.au=Vindi+M.+Jayasinghe-Arachchige,++Lukun+Wang,++Rajeev+Prabhakar">[ASAP] Promiscuous Catalytic Activity of a Binuclear Metallohydrolase:
           Peptide and Phosphoester Hydrolyses

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      Authors: Leonardo F. Serafim; Vindi M. Jayasinghe-Arachchige, Lukun Wang, Rajeev Prabhakar
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00214
      PubDate: Fri, 22 Apr 2022 04:00:00 GMT
       
  • [ASAP] RetroGNN: Fast Estimation of Synthesizability for Virtual Screening
           and De Novo Design by Learning from Slow Retrosynthesis Software

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      Authors: Cheng-Hao Liu; Maksym Korablyov, Stanisaw Jastrzębski, Pawe Wodarczyk-Pruszyński, Yoshua Bengio, Marwin Segler
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01476
      PubDate: Fri, 22 Apr 2022 04:00:00 GMT
       
  • [ASAP] Pose Classification Using Three-Dimensional Atomic Structure-Based
           Neural Networks Applied to Ion Channel–Ligand Docking

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      Authors: Heesung Shim; Hyojin Kim, Jonathan E. Allen, Heike Wulff
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01510
      PubDate: Thu, 21 Apr 2022 04:00:00 GMT
       
  • [ASAP] Novel US-CpHMD Protocol to Study the Protonation-Dependent
           Mechanism of the ATP/ADP Carrier

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      Authors: Nuno F. B. Oliveira; Miguel Machuqueiro
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00233
      PubDate: Wed, 20 Apr 2022 04:00:00 GMT
       
  • [ASAP] CLAffinity: A Software Tool for Identification of Optimum Ligand
           Affinity for Competition-Based Primary Screens

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      Authors: Steven Shave; Nhan T. Pham, Manfred Auer
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00285
      PubDate: Wed, 20 Apr 2022 04:00:00 GMT
       
  • [ASAP] Community Reaction Network Reduction for Constructing a
           Coarse-Grained Representation of Combustion Reaction Mechanisms

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      Authors: Lin Ji; Yue Li, Jie Wang, An Ning, Naixin Zhang, Shengyao Liang, Jiyun He, Tianyu Zhang, Zexing Qu, Jiali Gao
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00240
      PubDate: Wed, 20 Apr 2022 04:00:00 GMT
       
  • [ASAP] 3‑Input AND Molecular Logic Gate with Enhanced Fluorescence
           Output: The Key Atom for the Accurate Prediction of the Spectra

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      Authors: Christina Eleftheria Tzeliou; Demeter Tzeli
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00257
      PubDate: Tue, 19 Apr 2022 04:00:00 GMT
       
  • [ASAP] Current Trends in Computational Quantum Chemistry Studies on
           Antioxidant Radical Scavenging Activity

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      Authors: Maciej Spiegel
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00104
      PubDate: Mon, 18 Apr 2022 04:00:00 GMT
       
  • [ASAP] Impact of Remdesivir Incorporation along the Primer Strand on
           SARS-CoV‑2 RNA-Dependent RNA Polymerase

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      Authors: Sehr Naseem-Khan; Madison B. Berger, Emmett M. Leddin, Yazdan Maghsoud, G. Andrés Cisneros
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00201
      PubDate: Mon, 18 Apr 2022 04:00:00 GMT
       
  • [ASAP] Target Recognition in Tandem WW Domains: Complex Structures for
           Parallel and Antiparallel Ligand Orientation in h‑FBP21 Tandem WW

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      Authors: Marius T. Wenz; Miriam Bertazzon, Jana Sticht, Stevan Aleksić, Daniela Gjorgjevikj, Christian Freund, Bettina G. Keller
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01426
      PubDate: Tue, 29 Mar 2022 04:00:00 GMT
       
  • [ASAP] Standard Binding Free Energy and Membrane Desorption Mechanism for
           a Phospholipase C

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      Authors: Emmanuel E. Moutoussamy; Hanif M. Khan, Mary F. Roberts, Anne Gershenson, Christophe Chipot, Nathalie Reuter
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01543
      PubDate: Mon, 28 Mar 2022 04:00:00 GMT
       
  • [ASAP] Ligand-Dependent Modulation of the Dynamics of Intracellular Loops
           Dictates Functional Selectivity of 5‑HT2AR

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      Authors: Sukanya Mozumder; Aritra Bej, Jayati Sengupta
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00118
      PubDate: Thu, 24 Mar 2022 04:00:00 GMT
       
  • [ASAP] Inhibition of Aβ16–22 Peptide Aggregation by Small Molecules and
           Their Permeation through POPC Lipid Bilayer: Insight from Molecular
           Dynamics Simulation Study

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      Authors: Rabindranath Paul; Siddhartha Bera, Madhusmita Devi, Sandip Paul
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01366
      PubDate: Mon, 21 Mar 2022 04:00:00 GMT
       
  • [ASAP] Identifying Novel Inhibitors for Hepatic Organic Anion Transporting
           Polypeptides by Machine Learning-Based Virtual Screening

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      Authors: Alzbeta Tuerkova; Brandon J. Bongers, Ulf Norinder, Orsolya Ungvári, Virág Székely, Andrey Tarnovskiy, Gergely Szakács, Csilla Özvegy-Laczka, Gerard J. P. van Westen, Barbara Zdrazil
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01460
      PubDate: Fri, 11 Mar 2022 05:00:00 GMT
       
  • [ASAP] The Value of Peer Mentoring Networks for Developing Leaders and
           Inspiring Change

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      Authors: Chrystal D. Bruce; Patricia M. Flatt, Sarah R. Kirk, Elizabeth Roberts-Kirchhoff, Hala G. Schepmann
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.2c00155
      PubDate: Fri, 25 Feb 2022 05:00:00 GMT
       
  • [ASAP] iANP-EC: Identifying Anticancer Natural Products Using Ensemble
           Learning Incorporated with Evolutionary Computation

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      Authors: Loc Nguyen; Thanh-Hoang Nguyen Vo, Quang H. Trinh, Bach Hoai Nguyen, Phuong-Uyen Nguyen-Hoang, Ly Le, Binh P. Nguyen
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c00920
      PubDate: Mon, 14 Feb 2022 05:00:00 GMT
       
  • [ASAP] Effect of an Inhibitor on the ACE2-Receptor-Binding Domain of
           SARS-CoV‑2

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      Authors: Gaurav Sharma; Lin Frank Song, Kenneth M. Merz
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01283
      PubDate: Fri, 04 Feb 2022 05:00:00 GMT
       
  • [ASAP] Phosphorylation Regulation on the Homo-Dimeric Binding of
           Transactive Response DNA-Binding Protein

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      Authors: Wanqian Dong; Rui Zhou, Jiawen Chen, Zhengyu Shu, Mojie Duan
      Abstract: TOC GraphicJournal of Chemical Information and Modeling
      DOI : 10.1021/acs.jcim.1c01224
      PubDate: Tue, 18 Jan 2022 05:00:00 GMT
       
 
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