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Application

Discovery Studio 0.9738910012674271 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0591626213592233 Amorphous Cell 0.2779126213592233 Blends 0.00212378640776699 CASTEP 0.3094660194174757 CDOCKER 0.1638349514563107 CHARMm 0.2688106796116505 COMPASS 0.34101941747572817 COMPASS III 0.10740291262135922 COSMObase 0.0048543689320388345 COSMOconf 0.0054611650485436895 COSMOmic 0.0 COSMOperm 6.067961165048543E-4 COSMOplex 3.0339805825242716E-4 COSMOquick 9.101941747572816E-4 COSMOtherm 0.06219660194174757 Catalyst 0.06887135922330097 Classical Simulations 1.0 Conformers 3.0339805825242716E-4 Crystallization 0.07281553398058252 DFTB Plus 0.0036407766990291263 DMol3 0.14684466019417475 DPD 0.0024271844660194173 Discover 0.0054611650485436895 Forcite 0.5236650485436893 GULP 0.01699029126213592 Kinetix 0.0 LUDI 0.0036407766990291263 LibDock 0.06765776699029126 LigandFit 0.003337378640776699 MODELER 0.2487864077669903 MesoDyn 6.067961165048543E-4 Mesocite 0.0036407766990291263 Mesoscale 0.006371359223300971 Morphology 0.01608009708737864 ONETEP 6.067961165048543E-4 Polymorph 0.0027305825242718447 QMERA 3.0339805825242716E-4 QSAR 6.067961165048543E-4 Quantum Mechanics 0.44781553398058255 Reflex 0.05279126213592233 Reflex Plus 6.067961165048543E-4 Semi-empirical 0.0048543689320388345 Sorption 0.056735436893203886 Synthia 9.101941747572816E-4 TURBOMOLE 0.0 VAMP 3.0339805825242716E-4 Visualization 0.6695995145631068 X-Cell 0.001516990291262136 ZDOCK 0.027912621359223302

Year

2024 0.14792752544055596 2025 1.0 2026 0.9379498634896997 2027 0.0

Keywords

target 1.0 potential 0.3204376090058665 analysis 0.22831774219121612 docking 0.22324401458696685 visualization 0.16140795941017916 between 0.14174726494371334 promising 0.09433962264150944 novel 0.09164420485175202 binding 0.0761059140637387 energy 0.07372760424924688 cell 0.06389725701601395 stability 0.04439511653718091 activity 0.04280957666085302 performance 0.03963849690819724 including 0.0258442999841446 strong 0.0258442999841446 enhanced 0.016331060726177262 effective 0.015855398763278898 development 0.013159980973521484 synthesized 0.010464563183764071 mechanism 0.00935468527033455 strategy 0.006976375455842714 experimental 0.003171079752655779 interaction 0.0011098779134295228 design 0.0
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