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Application

Discovery Studio 0.7428571428571429 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04189944134078212 Amorphous Cell 0.1564245810055866 CASTEP 0.6089385474860335 CDOCKER 0.11452513966480447 CHARMm 0.2709497206703911 COMPASS 0.3016759776536313 COMPASS III 0.0111731843575419 COSMOtherm 0.04189944134078212 Catalyst 0.164804469273743 Classical Simulations 0.8240223463687151 Conformers 0.002793296089385475 Crystallization 0.06983240223463687 DFTB Plus 0.002793296089385475 DMol3 0.40502793296089384 DPD 0.00558659217877095 Discover 0.05027932960893855 Forcite 0.28212290502793297 GULP 0.0670391061452514 LUDI 0.0111731843575419 LibDock 0.0446927374301676 LigandFit 0.05865921787709497 MODELER 0.276536312849162 MesoDyn 0.0 Mesocite 0.002793296089385475 Mesoscale 0.0111731843575419 Morphology 0.0223463687150838 ONETEP 0.002793296089385475 Polymorph 0.002793296089385475 QSAR 0.00558659217877095 Quantum Mechanics 1.0 Reflex 0.03910614525139665 Reflex Plus 0.002793296089385475 Semi-empirical 0.008379888268156424 Sorption 0.030726256983240222 VAMP 0.002793296089385475 Visualization 0.6508379888268156 X-Cell 0.002793296089385475 ZDOCK 0.019553072625698324

Year

2003 0.0 2004 0.029411764705882353 2005 0.047058823529411764 2006 0.041176470588235294 2007 0.052941176470588235 2008 0.09411764705882353 2009 0.21176470588235294 2010 0.27058823529411763 2011 0.2529411764705882 2012 0.06470588235294118 2013 0.047058823529411764 2014 0.27058823529411763 2015 0.27647058823529413 2016 0.08823529411764706 2017 0.27647058823529413 2018 0.4588235294117647 2019 0.17647058823529413 2020 1.0 2021 0.3588235294117647 2022 0.5647058823529412 2023 0.38823529411764707 2024 0.6470588235294118 2025 0.17647058823529413 2026 0.08823529411764706

Keywords

analysis 1.0 target 0.9644839067702553 between 0.21087680355160932 potential 0.15871254162042175 docking 0.15538290788013318 visualization 0.12763596004439512 energy 0.12097669256381798 experimental 0.08990011098779134 interaction 0.08102108768035517 binding 0.0732519422863485 novel 0.07214206437291898 chemical 0.048834628190899 well 0.04439511653718091 activity 0.033296337402885685 protein 0.033296337402885685 surface 0.03218645948945616 mechanism 0.02885682574916759 synthesized 0.0244173140954495 cell 0.021087680355160933 role 0.009988901220865706 including 0.005549389567147614 x-ray 0.003329633740288568 higher 0.0011098779134295228 synthesis 0.0011098779134295228 complex 0.0
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