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Application

Discovery Studio 0.8829787234042553 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.061253062653132656 Amorphous Cell 0.2863143157157858 Blends 0.0021001050052502626 CASTEP 0.3136156807840392 CDOCKER 0.15400770038501926 CHARMm 0.24921246062303115 COMPASS 0.34756737836891843 COMPASS III 0.10955547777388869 COSMObase 0.0056002800140007 COSMOconf 0.006300315015750788 COSMOmic 0.0 COSMOperm 7.000350017500875E-4 COSMOplex 3.5001750087504374E-4 COSMOquick 3.5001750087504374E-4 COSMOtherm 0.06790339516975849 Catalyst 0.06755337766888345 Classical Simulations 1.0 Conformers 3.5001750087504374E-4 Crystallization 0.07700385019250963 DFTB Plus 0.0035001750087504373 DMol3 0.14700735036751839 DPD 0.0021001050052502626 Discover 0.004200210010500525 Forcite 0.5390269513475674 GULP 0.014350717535876793 Kinetix 0.0 LUDI 0.00280014000700035 LibDock 0.061953097654882744 LigandFit 0.003150157507875394 MODELER 0.2296114805740287 Mesocite 0.003150157507875394 Mesoscale 0.004900245012250612 Morphology 0.017850892544627232 ONETEP 0.0010500525026251313 Polymorph 0.0021001050052502626 QMERA 3.5001750087504374E-4 QSAR 0.0 Quantum Mechanics 0.45327266363318164 Reflex 0.055652782639131954 Reflex Plus 3.5001750087504374E-4 Semi-empirical 0.004900245012250612 Sorption 0.05950297514875744 Synthia 7.000350017500875E-4 TURBOMOLE 0.0 VAMP 3.5001750087504374E-4 Visualization 0.6282814140707035 X-Cell 0.0017500875043752187 ZDOCK 0.026251312565628283

Year

2024 0.05211267605633803 2025 0.9546478873239437 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.3112644535621037 analysis 0.2245430809399478 docking 0.20663931368892205 visualization 0.15218202163371877 between 0.14360313315926893 promising 0.09623274897426333 novel 0.08877284595300261 energy 0.08485639686684072 cell 0.07142857142857142 binding 0.0712420738530399 performance 0.0546437896307348 stability 0.04867586721372622 activity 0.040656471465870946 strong 0.03338306602014174 including 0.02928011935844834 enhanced 0.022752704214845206 strategy 0.020701230883998507 effective 0.01864975755315181 development 0.017344274524431182 mechanism 0.015852293920179037 experimental 0.013614323013800821 synthesized 0.012122342409548676 design 0.005221932114882507 interaction 0.0
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