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Application

Discovery Studio 1.0 Materials Studio 0.9080824088748018 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0936834634492548 Amorphous Cell 0.24485450674237047 Blends 0.0035486160397444995 CASTEP 0.28459900638750885 CDOCKER 0.17246273953158267 CHARMm 0.27253371185237757 COMPASS 0.34137686302342085 COMPASS III 0.085166784953868 COSMObase 0.0 COSMOconf 0.0042583392476933995 COSMOmic 0.0 COSMOperm 7.097232079489E-4 COSMOplex 0.0 COSMOquick 7.097232079489E-4 COSMOtherm 0.051809794180269694 Catalyst 0.1391057487579844 Classical Simulations 1.0 Crystallization 0.058907026259758695 DFTB Plus 0.0035486160397444995 DMol3 0.1937544357700497 DPD 0.0021291696238466998 Discover 0.0028388928317956 Forcite 0.5322924059616749 GULP 0.0127750177430802 LUDI 0.0049680624556423 LibDock 0.07594038325053229 LigandFit 0.0049680624556423 MODELER 0.2093683463449255 Mesocite 0.0014194464158978 Mesoscale 0.0042583392476933995 Morphology 0.014904187366926898 ONETEP 0.0 Polymorph 0.0 QSAR 0.0 Quantum Mechanics 0.47054648687012063 Reflex 0.04187366926898509 Reflex Plus 0.0 Semi-empirical 0.0049680624556423 Sorption 0.050390347764371894 TURBOMOLE 7.097232079489E-4 VAMP 7.097232079489E-4 Visualization 0.8005677785663591 X-Cell 0.0 ZDOCK 0.027679205110007096

Year

2022 0.019538188277087035 2023 0.2960331557134399 2024 0.596210775606868 2025 1.0 2026 0.354647720544701 2027 0.0

Keywords

effective 1.0 target 0.9400374765771393 potential 0.3307307932542161 docking 0.20955652717051843 analysis 0.1848844472204872 visualization 0.15490318550905685 novel 0.11805121798875702 between 0.1136789506558401 promising 0.07713928794503436 binding 0.06183635227982511 activity 0.056214865708931916 development 0.05121798875702686 energy 0.04871955028107433 cell 0.028107432854465958 treatment 0.025296689569019364 synthesized 0.021236727045596503 stability 0.020299812617114305 strategy 0.018425983760149905 performance 0.016864459712679577 interaction 0.01155527795128045 protein 0.008744534665833853 including 0.005309181761399126 inhibition 0.0028107432854465957 therapeutic 0.0024984384759525295 vitro 0.0
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