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Application

Discovery Studio 1.0 Materials Studio 0.8692480359147026 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.058823529411764705 Amorphous Cell 0.2691176470588235 Blends 0.003676470588235294 CASTEP 0.29705882352941176 CDOCKER 0.18382352941176472 CHARMm 0.2977941176470588 COMPASS 0.32279411764705884 COMPASS III 0.10661764705882353 COSMObase 0.004411764705882353 COSMOconf 0.0029411764705882353 COSMOperm 7.352941176470588E-4 COSMOtherm 0.05661764705882353 Catalyst 0.07794117647058824 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06838235294117648 DFTB Plus 0.0 DMol3 0.12279411764705882 DPD 0.0022058823529411764 Discover 0.0058823529411764705 Forcite 0.5022058823529412 GULP 0.011764705882352941 LUDI 0.004411764705882353 LibDock 0.075 LigandFit 0.003676470588235294 MODELER 0.2713235294117647 Mesocite 0.004411764705882353 Mesoscale 0.0058823529411764705 Morphology 0.013970588235294118 ONETEP 0.0 Polymorph 0.0022058823529411764 QMERA 0.0 Quantum Mechanics 0.4139705882352941 Reflex 0.05073529411764706 Reflex Plus 0.0 Semi-empirical 0.0014705882352941176 Sorption 0.05073529411764706 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.725 X-Cell 0.0014705882352941176 ZDOCK 0.03235294117647059

Year

2024 0.1060339777387229 2025 1.0 2026 0.9865260691271236 2027 0.0

Keywords

target 1.0 potential 0.3378839590443686 docking 0.2601441031475161 analysis 0.24497535077739857 visualization 0.17937049677664013 between 0.1296928327645051 promising 0.1012514220705347 binding 0.09518392112248768 novel 0.09480470231323473 activity 0.06560485400075844 cell 0.05612438376943497 energy 0.048919226393629126 strong 0.044747819491846794 stability 0.0428517254455821 including 0.026166097838452786 performance 0.02464922260144103 enhanced 0.020098596890405763 development 0.01820250284414107 effective 0.015927189988623434 mechanism 0.008342813803564657 therapeutic 0.007963594994311717 synthesized 0.00720515737580584 protein 0.004171406901782328 interaction 0.0037921880925293893 design 0.0
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