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Application

Discovery Studio 1.0 Materials Studio 0.8234729772945315 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05459272097053726 Amorphous Cell 0.2595320623916811 Blends 0.0025996533795493936 CASTEP 0.27989601386481805 CDOCKER 0.19194107452339687 CHARMm 0.3063258232235702 COMPASS 0.3240901213171577 COMPASS III 0.10398613518197573 COSMObase 0.0034662045060658577 COSMOconf 0.006499133448873483 COSMOmic 0.0 COSMOperm 8.665511265164644E-4 COSMOplex 4.332755632582322E-4 COSMOquick 0.0 COSMOtherm 0.059358752166377815 Catalyst 0.08448873483535528 Classical Simulations 1.0 Conformers 4.332755632582322E-4 Crystallization 0.07279029462738301 DFTB Plus 0.0017331022530329288 DMol3 0.1265164644714038 DPD 0.0017331022530329288 Discover 0.004332755632582322 Forcite 0.4987001733102253 GULP 0.01169844020797227 Kinetix 0.0 LUDI 0.00389948006932409 LibDock 0.07885615251299827 LigandFit 0.00389948006932409 MODELER 0.2833622183708839 Mesocite 0.00389948006932409 Mesoscale 0.005199306759098787 Morphology 0.016464471403812825 ONETEP 8.665511265164644E-4 Polymorph 0.002166377816291161 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.40121317157712305 Reflex 0.05285961871750433 Reflex Plus 0.0 Semi-empirical 0.0025996533795493936 Sorption 0.05415944540727903 Synthia 8.665511265164644E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7487001733102253 X-Cell 0.0012998266897746968 ZDOCK 0.033795493934142114

Year

2024 0.0732017823042648 2025 1.0 2026 0.8682367918523234 2027 0.0

Keywords

target 1.0 potential 0.3393665158371041 docking 0.2587804352510235 analysis 0.23012281835811246 visualization 0.18142641672053436 between 0.12324929971988796 novel 0.10084033613445378 promising 0.09739280327515622 binding 0.09286791639732817 activity 0.06227106227106227 cell 0.05192846369316958 energy 0.04244774833010127 stability 0.041154923507864684 strong 0.031027795733678087 including 0.029088558500323207 development 0.018530489118724413 performance 0.018315018315018316 therapeutic 0.016591251885369532 effective 0.012928248222365869 synthesized 0.008187890540831718 mechanism 0.00689506571859513 protein 0.0053867700926524455 enhanced 0.005171299288946348 strategy 0.003878474466709761 interaction 0.0
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