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Application

Discovery Studio 0.9375580007954395 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06446776611694154 Amorphous Cell 0.2841912377144761 Blends 0.001999000499750125 CASTEP 0.3486590038314176 CDOCKER 0.15825420623021821 CHARMm 0.2595368982175579 COMPASS 0.34699317008162583 COMPASS III 0.09928369148758955 COSMObase 0.004331167749458604 COSMOconf 0.005497251374312844 COSMOmic 0.0 COSMOperm 6.663334999167084E-4 COSMOplex 1.665833749791771E-4 COSMOquick 0.0014992503748125937 COSMOtherm 0.06580043311677494 Catalyst 0.08762285523904714 Classical Simulations 1.0 Conformers 3.331667499583542E-4 Crystallization 0.07063135099117109 DFTB Plus 0.004164584374479427 DMol3 0.15858737298017658 DPD 0.002165583874729302 Discover 0.003664834249541896 Forcite 0.5347326336831584 GULP 0.01899050474762619 Kinetix 1.665833749791771E-4 LUDI 0.0034982508745627187 LibDock 0.06630018324171248 LigandFit 0.00399800099950025 MCSS 4.997501249375312E-4 MODELER 0.23155089122105613 MesoDyn 6.663334999167084E-4 Mesocite 0.0033316674995835416 Mesoscale 0.005830418124271198 Modules 0.0 Morphology 0.01665833749791771 ONETEP 8.329168748958854E-4 Polymorph 0.001832417124770948 QMERA 1.665833749791771E-4 QSAR 6.663334999167084E-4 Quantum Mechanics 0.49691820756288524 Reflex 0.050974512743628186 Reflex Plus 8.329168748958854E-4 Semi-empirical 0.00566383474929202 Sorption 0.05463934699317008 Synthia 9.995002498750624E-4 TURBOMOLE 3.331667499583542E-4 VAMP 9.995002498750624E-4 Visualization 0.7083125104114609 X-Cell 0.0016658337497917708 ZDOCK 0.026653339996668333

Year

2023 0.06648557754494891 2024 0.4316388565515457 2025 1.0 2026 0.547794593196223 2027 0.0

Keywords

target 1.0 potential 0.29406638675433733 docking 0.20977580606828805 analysis 0.20581478253980828 visualization 0.16683831101956745 between 0.15051889408223085 novel 0.09411391903667908 energy 0.08302305315693576 promising 0.07470490374712825 binding 0.0673373999841559 cell 0.06266339222054979 activity 0.042382951754733424 stability 0.04032321951992395 performance 0.0394517943436584 including 0.021310306583221104 synthesized 0.018379149172146083 experimental 0.017824605878158917 effective 0.016953180701893368 interaction 0.015764873643349442 development 0.012912936702844015 mechanism 0.012437613879426443 enhanced 0.008397369880377089 strong 0.0021389527053790698 protein 0.0018220708231006892 design 0.0
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