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Application

Discovery Studio 0.6809324982602645 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0587012987012987 Amorphous Cell 0.24 Antibody 0.001038961038961039 Blends 0.01090909090909091 CASTEP 0.36727272727272725 CDOCKER 0.16207792207792207 CHARMm 0.3028571428571429 COMPASS 0.38805194805194804 COMPASS III 0.009870129870129871 COSMOconf 0.001038961038961039 COSMOmic 0.0 COSMOquick 5.194805194805195E-4 COSMOtherm 0.04935064935064935 Catalyst 0.15376623376623377 Classical Simulations 1.0 Conformers 0.003116883116883117 Crystallization 0.045714285714285714 DFTB Plus 0.004155844155844156 DMol3 0.4903896103896104 DPD 0.016623376623376623 Discover 0.06909090909090909 Forcite 0.36103896103896105 GULP 0.0638961038961039 LUDI 0.016103896103896103 LibDock 0.04883116883116883 LigandFit 0.0451948051948052 MCSS 0.001038961038961039 MODELER 0.31116883116883115 MesoDyn 0.007792207792207792 Mesocite 0.005714285714285714 Mesoscale 0.02857142857142857 Morphology 0.0187012987012987 ONETEP 0.003116883116883117 Polymorph 0.0036363636363636364 QMERA 0.0 QSAR 0.003116883116883117 Quantum Mechanics 0.8322077922077922 Reflex 0.02181818181818182 Reflex Plus 0.0025974025974025974 Semi-empirical 0.009870129870129871 Sorption 0.043116883116883116 Synthia 5.194805194805195E-4 TURBOMOLE 0.001038961038961039 VAMP 0.004675324675324675 Visualization 0.454025974025974 X-Cell 0.001038961038961039 ZDOCK 0.05090909090909091

Year

2003 0.009157509157509158 2004 0.056776556776556776 2005 0.07326007326007326 2006 0.09523809523809523 2007 0.163003663003663 2008 0.2032967032967033 2009 0.25274725274725274 2010 0.30036630036630035 2011 0.15384615384615385 2012 0.1978021978021978 2013 0.41208791208791207 2014 0.6410256410256411 2015 0.76007326007326 2016 0.63003663003663 2017 0.4084249084249084 2018 0.4926739926739927 2019 0.4725274725274725 2020 0.7216117216117216 2021 0.3315018315018315 2022 1.0 2023 0.7124542124542125 2024 0.2967032967032967 2025 0.0695970695970696 2026 0.0

Keywords

interaction 1.0 target 0.9402654867256637 between 0.4820796460176991 energy 0.15464601769911504 binding 0.1502212389380531 docking 0.13761061946902656 analysis 0.1261061946902655 surface 0.10464601769911504 experimental 0.09535398230088496 potential 0.09336283185840707 adsorption 0.07300884955752213 mechanism 0.07013274336283186 well 0.06482300884955752 visualization 0.06371681415929203 protein 0.05796460176991151 cell 0.05309734513274336 chemical 0.050442477876106194 role 0.029424778761061948 complex 0.023008849557522124 novel 0.02079646017699115 activity 0.01991150442477876 strong 0.017256637168141593 higher 0.013495575221238938 formation 0.008185840707964602 modeler 0.0
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