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Application

Discovery Studio 1.0 Materials Studio 0.5828119466414827 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06223277909738718 Amorphous Cell 0.1496437054631829 Antibody 0.0 Blends 0.0028503562945368173 CASTEP 0.4054631828978622 CDOCKER 0.37505938242280285 CHARMm 0.47030878859857483 COMPASS 0.2669833729216152 COMPASS III 0.0334916864608076 COSMObase 0.0011876484560570072 COSMOconf 7.125890736342043E-4 COSMOmic 2.3752969121140142E-4 COSMOperm 2.3752969121140142E-4 COSMOplex 0.0 COSMOquick 0.0021377672209026127 COSMOtherm 0.0505938242280285 Catalyst 0.37482185273159146 Classical Simulations 1.0 Conformers 0.0014251781472684087 Crystallization 0.07790973871733967 DFTB Plus 0.004750593824228029 DMol3 0.233729216152019 DPD 0.005700712589073635 Discover 0.014251781472684086 Forcite 0.3496437054631829 GULP 0.022565320665083134 LUDI 0.021852731591448932 LibDock 0.12921615201900238 LigandFit 0.048456057007125894 MCSS 0.004750593824228029 MODELER 0.3714964370546318 MesoDyn 0.0030878859857482186 Mesocite 0.004513064133016627 Mesoscale 0.010926365795724466 Morphology 0.012826603325415678 ONETEP 0.0021377672209026127 Polymorph 0.0040380047505938245 QMERA 4.7505938242280285E-4 QSAR 0.0030878859857482186 Quantum Mechanics 0.6256532066508314 Reflex 0.06033254156769596 Reflex Plus 0.0011876484560570072 Semi-empirical 0.007363420427553444 Sorption 0.02327790973871734 Synthia 0.0011876484560570072 TURBOMOLE 7.125890736342043E-4 VAMP 0.00166270783847981 Visualization 0.9581947743467933 X-Cell 0.0040380047505938245 ZDOCK 0.039429928741092635

Year

2001 4.0617384240454913E-4 2002 0.0012185215272136475 2003 0.002843216896831844 2004 0.002437043054427295 2005 0.003249390739236393 2006 0.005686433793663688 2007 0.008529650690495532 2008 0.017871649065800164 2009 0.020714865962632008 2010 0.03899268887083672 2011 0.06295694557270512 2012 0.06986190089358245 2013 0.08732737611697806 2014 0.10154346060113728 2015 0.12510154346060115 2016 0.12388302193338749 2017 0.15678310316815597 2018 0.21770917952883834 2019 0.335093419983753 2020 0.40129975629569453 2021 0.46222583265637696 2022 0.5381803411860276 2023 0.7587327376116978 2024 1.0 2025 0.9220146222583265 2026 0.22948822095857027 2027 0.0

Keywords

novel 1.0 target 0.9632408102025506 potential 0.27206801700425104 docking 0.2592314745353005 visualization 0.1661248645494707 analysis 0.138367925314662 synthesized 0.13378344586146537 synthesis 0.10794365257981162 activity 0.10644327748603817 binding 0.08718846378261232 between 0.08543802617320997 compound 0.07835292156372427 promising 0.06801700425106276 design 0.06543302492289739 development 0.06326581645411353 drug 0.03375843960990248 protein 0.032758189547386844 potent 0.027840293406685004 vitro 0.020171709594065182 inhibition 0.01933816787530216 cell 0.016004001000250064 effective 0.005751437859464866 energy 0.0035842293906810036 chemical 3.334166875052096E-4 interaction 0.0
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