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Application

Discovery Studio 0.9068257123923128 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06678291194420227 Amorphous Cell 0.25998256320836965 Antibody 6.974716652136007E-4 Blends 0.01028770706190061 CASTEP 0.3016564952048823 CDOCKER 0.16111595466434175 CHARMm 0.2892763731473409 COMPASS 0.4045335658238884 COMPASS III 0.025806451612903226 COSMObase 5.231037489102005E-4 COSMOconf 0.0012205754141238012 COSMOmic 6.974716652136007E-4 COSMOperm 5.231037489102005E-4 COSMOplex 1.743679163034002E-4 COSMOquick 0.0012205754141238012 COSMOtherm 0.043243243243243246 Catalyst 0.12327811682650393 Classical Simulations 1.0 Conformers 0.0013949433304272015 Crystallization 0.045684394071490844 DFTB Plus 0.007497820401046207 DMol3 0.35396687009590233 DPD 0.012554489973844812 Discover 0.04673060156931125 Forcite 0.43295553618134264 GULP 0.044463818657367045 Kinetix 0.0 LUDI 0.01150828247602441 LibDock 0.05789014821272886 LigandFit 0.023888404533565825 MCSS 0.0012205754141238012 MODELER 0.26887532693984306 MesoDyn 0.006800348735832607 Mesocite 0.0076721883173496075 Mesoscale 0.023365300784655624 Morphology 0.02005231037489102 ONETEP 0.0034873583260680036 Polymorph 0.002266782911944202 QMERA 5.231037489102005E-4 QSAR 0.0017436791630340018 Quantum Mechanics 0.6362685265911072 Reflex 0.022842197035745422 Reflex Plus 0.002789886660854403 Semi-empirical 0.012205754141238012 Sorption 0.04603312990409764 Synthia 0.0013949433304272015 TURBOMOLE 6.974716652136007E-4 VAMP 0.0038360941586748037 Visualization 0.642720139494333 X-Cell 6.974716652136007E-4 ZDOCK 0.053530950305143855

Year

2001 0.0 2002 0.0010178117048346056 2003 0.01272264631043257 2004 0.014249363867684479 2005 0.017302798982188294 2006 0.02391857506361323 2007 0.042748091603053436 2008 0.0539440203562341 2009 0.06768447837150127 2010 0.10229007633587786 2011 0.1256997455470738 2012 0.16895674300254454 2013 0.2152671755725191 2014 0.24223918575063613 2015 0.26259541984732826 2016 0.28396946564885495 2017 0.3150127226463104 2018 0.37608142493638674 2019 0.44529262086513993 2020 0.5206106870229008 2021 0.6076335877862595 2022 0.6982188295165395 2023 0.8290076335877863 2024 1.0 2025 0.8213740458015267 2026 0.11806615776081425

Keywords

interaction 1.0 target 0.9496577946768061 between 0.45657794676806085 docking 0.20912547528517111 analysis 0.17155893536121672 potential 0.1638022813688213 binding 0.1626615969581749 energy 0.14 visualization 0.13133079847908746 mechanism 0.07787072243346008 experimental 0.07536121673003802 protein 0.06593155893536122 surface 0.0634980988593156 cell 0.051634980988593156 adsorption 0.04403041825095057 well 0.03718631178707224 novel 0.03460076045627376 activity 0.023269961977186313 chemical 0.01817490494296578 role 0.01749049429657795 complex 0.014904942965779468 strong 0.012775665399239544 higher 0.002965779467680608 stability 7.604562737642586E-5 drug 0.0
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