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Application

Discovery Studio 0.8651395848246242 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.1142279504675259 Amorphous Cell 0.14379580490270408 Antibody 0.0 Blends 0.003032600454890068 CASTEP 0.6340662117765984 CDOCKER 0.2532221379833207 CHARMm 0.29668941117007835 COMPASS 0.3356077836745009 COMPASS III 0.026282537275713926 COSMObase 0.0 COSMOconf 5.054334091483447E-4 COSMOmic 2.5271670457417233E-4 COSMOperm 2.5271670457417233E-4 COSMOquick 5.054334091483447E-4 COSMOtherm 0.03639120545868082 Catalyst 0.29492039423805916 Classical Simulations 1.0 Conformers 0.0017690169320192064 Crystallization 0.1753853929744756 DFTB Plus 0.006317917614354309 DMol3 0.3179176143543088 DPD 0.0075815011372251705 Discover 0.02779883750315896 Equilibria 0.0 Forcite 0.42279504675259033 GULP 0.03436947182208744 LUDI 0.009350518069244376 LibDock 0.062421026029820574 LigandFit 0.029315137730603992 MCSS 0.0035380338640384128 MODELER 0.1518827394490776 MesoDyn 0.0035380338640384128 Mesocite 0.0037907505686125853 Mesoscale 0.013646702047005308 Morphology 0.020975486479656306 ONETEP 2.5271670457417233E-4 Polymorph 0.006065200909780136 QMERA 7.58150113722517E-4 QSAR 0.0027798837503158957 Quantum Mechanics 0.935557240333586 Reflex 0.14152135456153653 Reflex Plus 0.010108668182966895 Semi-empirical 0.014657568865301996 Sorption 0.0502906242102603 Synthia 0.0025271670457417236 TURBOMOLE 5.054334091483447E-4 VAMP 0.0070760677280768255 Visualization 0.9092747030578722 X-Cell 0.00530705079605762 ZDOCK 0.006570634318928481

Year

2001 0.0011235955056179776 2002 0.003932584269662922 2003 0.0022471910112359553 2004 0.007865168539325843 2005 0.008426966292134831 2006 0.016853932584269662 2007 0.019101123595505618 2008 0.03258426966292135 2009 0.05112359550561798 2010 0.06573033707865168 2011 0.10449438202247191 2012 0.13651685393258428 2013 0.1853932584269663 2014 0.21797752808988763 2015 0.27808988764044945 2016 0.26741573033707866 2017 0.33146067415730335 2018 0.3949438202247191 2019 0.49157303370786515 2020 0.5404494382022472 2021 0.6157303370786517 2022 0.702808988764045 2023 0.8488764044943821 2024 1.0 2025 0.9174157303370787 2026 0.298314606741573 2027 0.0

Keywords

synthesized 1.0 target 0.9667877529839128 synthesis 0.30729977512541085 novel 0.21760941013665455 docking 0.20956581906244595 potential 0.16779103961252378 visualization 0.14746583636049126 compound 0.1457360318284034 analysis 0.09462030790520672 activity 0.09332295450614081 between 0.09107420861442657 designed 0.059245805224009684 design 0.05275903822868016 experimental 0.0480885659920429 binding 0.04298564262238367 promising 0.0426396817159661 potent 0.03226085452343885 inhibition 0.02871475523265871 vitro 0.02170904687770282 energy 0.019200830306175403 well 0.012368102404428299 cell 0.007870610620999826 x-ray 0.006746237675142709 chemical 0.005881335409098772 active 0.0
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