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Application

Discovery Studio 0.9235421166306695 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.051321138211382115 Amorphous Cell 0.2815040650406504 Blends 0.0020325203252032522 CASTEP 0.2804878048780488 CDOCKER 0.15955284552845528 CHARMm 0.25558943089430897 COMPASS 0.34247967479674796 COMPASS III 0.11991869918699187 COSMObase 0.004573170731707317 COSMOconf 0.007113821138211382 COSMOmic 0.0 COSMOperm 5.081300813008131E-4 COSMOplex 5.081300813008131E-4 COSMOquick 0.0 COSMOtherm 0.06453252032520325 Catalyst 0.07215447154471545 Classical Simulations 1.0 Conformers 5.081300813008131E-4 Crystallization 0.0782520325203252 DFTB Plus 0.003556910569105691 DMol3 0.13211382113821138 DPD 0.001524390243902439 Discover 0.003556910569105691 Forcite 0.5340447154471545 GULP 0.011686991869918699 Kinetix 0.0 LUDI 0.001524390243902439 LibDock 0.06453252032520325 LigandFit 0.003556910569105691 MODELER 0.2306910569105691 Mesocite 0.003556910569105691 Mesoscale 0.004573170731707317 Morphology 0.018292682926829267 ONETEP 0.0010162601626016261 Polymorph 0.003048780487804878 QMERA 0.0 Quantum Mechanics 0.4065040650406504 Reflex 0.05538617886178862 Reflex Plus 0.0 Semi-empirical 0.0040650406504065045 Sorption 0.06707317073170732 Synthia 0.0010162601626016261 TURBOMOLE 0.0 Visualization 0.6224593495934959 X-Cell 0.001524390243902439 ZDOCK 0.027439024390243903

Year

2024 0.0 2025 0.8791166214645486 2026 1.0 2027 0.0038744672607516468

Keywords

target 1.0 potential 0.3072916666666667 analysis 0.21271929824561403 docking 0.20860745614035087 visualization 0.14473684210526316 between 0.13294956140350878 promising 0.09073464912280702 novel 0.08525219298245613 energy 0.07538377192982457 binding 0.0644188596491228 cell 0.06414473684210527 performance 0.04276315789473684 activity 0.03919956140350877 stability 0.03782894736842105 strong 0.034265350877192985 including 0.03070175438596491 strategy 0.022478070175438597 development 0.01425438596491228 effective 0.012883771929824562 enhanced 0.012335526315789474 mechanism 0.00932017543859649 therapeutic 0.00932017543859649 synthesized 0.00712719298245614 experimental 0.003289473684210526 design 0.0
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