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Application

Discovery Studio 1.0 Materials Studio 0.406799531066823 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05454545454545454 Amorphous Cell 0.13863636363636364 Blends 0.0 CASTEP 0.2909090909090909 CDOCKER 0.22727272727272727 CHARMm 0.44772727272727275 COMPASS 0.17045454545454544 COMPASS III 0.05909090909090909 COSMObase 0.004545454545454545 COSMOconf 0.006818181818181818 COSMOmic 0.0 COSMOperm 0.0 COSMOtherm 0.056818181818181816 Catalyst 0.10454545454545454 Classical Simulations 0.8545454545454545 Crystallization 0.038636363636363635 DFTB Plus 0.004545454545454545 DMol3 0.1159090909090909 Discover 0.0 Forcite 0.28863636363636364 GULP 0.01818181818181818 LUDI 0.00909090909090909 LibDock 0.10909090909090909 LigandFit 0.0 MODELER 0.41818181818181815 Mesocite 0.0022727272727272726 Mesoscale 0.0022727272727272726 Morphology 0.013636363636363636 Polymorph 0.0 QMERA 0.0 Quantum Mechanics 0.3977272727272727 Reflex 0.020454545454545454 Semi-empirical 0.006818181818181818 Sorption 0.020454545454545454 Visualization 1.0 X-Cell 0.0 ZDOCK 0.031818181818181815

Year

2024 0.0 2025 1.0 2026 0.375366568914956

Keywords

analysis 1.0 target 0.8843984962406015 potential 0.45770676691729323 docking 0.42951127819548873 visualization 0.2161654135338346 binding 0.19454887218045114 between 0.1475563909774436 promising 0.11466165413533834 including 0.08928571428571429 therapeutic 0.07800751879699248 protein 0.07706766917293233 novel 0.07612781954887218 stability 0.07518796992481203 activity 0.07048872180451128 silico 0.06390977443609022 strong 0.05545112781954887 interaction 0.02631578947368421 inhibition 0.020676691729323307 vitro 0.016917293233082706 effective 0.015037593984962405 treatment 0.010338345864661654 mechanism 0.006578947368421052 compound 0.002819548872180451 energy 0.0018796992481203006 development 0.0
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