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Application

Discovery Studio 1.0 Materials Studio 0.7944397641112048 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05304518664047151 Amorphous Cell 0.2601178781925344 Blends 0.0019646365422396855 CASTEP 0.2734774066797642 CDOCKER 0.19724950884086445 CHARMm 0.3104125736738703 COMPASS 0.31787819253438115 COMPASS III 0.10569744597249509 COSMObase 0.005108055009823182 COSMOconf 0.006286836935166994 COSMOmic 0.0 COSMOperm 3.929273084479371E-4 COSMOplex 3.929273084479371E-4 COSMOquick 7.858546168958742E-4 COSMOtherm 0.06444007858546169 Catalyst 0.08958742632612966 Classical Simulations 1.0 Conformers 3.929273084479371E-4 Crystallization 0.0719056974459725 DFTB Plus 0.004715127701375246 DMol3 0.13398821218074655 DPD 0.003536345776031434 Discover 0.003143418467583497 Forcite 0.4907662082514735 GULP 0.015324165029469547 Kinetix 0.0 LUDI 0.003143418467583497 LibDock 0.07897838899803536 LigandFit 0.003929273084479371 MODELER 0.28526522593320236 Mesocite 0.003536345776031434 Mesoscale 0.0066797642436149315 Morphology 0.016110019646365423 ONETEP 0.0011787819253438114 Polymorph 0.002357563850687623 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.4023575638506876 Reflex 0.05147347740667976 Reflex Plus 7.858546168958742E-4 Semi-empirical 0.00550098231827112 Sorption 0.05776031434184676 Synthia 0.0011787819253438114 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7921414538310413 X-Cell 7.858546168958742E-4 ZDOCK 0.03025540275049116

Year

2024 0.30795314426633785 2025 1.0 2026 0.8091861898890259 2027 0.0

Keywords

target 1.0 potential 0.3295901179112858 docking 0.26370952648324913 analysis 0.23825566161332584 visualization 0.1948343627175744 between 0.13176118285607336 promising 0.09769792251544077 novel 0.095826314804417 binding 0.09283174246677896 activity 0.06513194834362718 cell 0.05259217667976792 energy 0.051094890510948905 stability 0.039303761931499155 including 0.028635597978663673 synthesized 0.019651880965749578 effective 0.01647014785700917 performance 0.01590866554370204 strong 0.015160022459292532 development 0.013662736290473517 therapeutic 0.011416807037244993 protein 0.011229646266142616 mechanism 0.009732360097323601 interaction 0.006176305446378439 strategy 0.0018716077110237693 enhanced 0.0
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