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Application

Discovery Studio 1.0 Materials Studio 0.7336024217961655 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04909560723514212 Amorphous Cell 0.13798449612403102 Blends 0.0031007751937984496 CASTEP 0.4542635658914729 CDOCKER 0.2103359173126615 CHARMm 0.24857881136950905 COMPASS 0.2811369509043928 COMPASS III 0.002583979328165375 COSMOconf 0.0010335917312661498 COSMOmic 5.167958656330749E-4 COSMOperm 0.0015503875968992248 COSMOquick 0.0015503875968992248 COSMOtherm 0.05271317829457364 Catalyst 0.07131782945736434 Classical Simulations 0.7390180878552972 Conformers 0.0010335917312661498 Crystallization 0.06304909560723514 DFTB Plus 0.0031007751937984496 DMol3 0.20310077519379846 DPD 0.007235142118863049 Discover 0.013953488372093023 Forcite 0.27700258397932814 GULP 0.03669250645994832 LUDI 0.009302325581395349 LibDock 0.0702842377260982 LigandFit 0.017054263565891473 MCSS 0.004651162790697674 MODELER 0.2780361757105943 MesoDyn 0.004134366925064599 Mesocite 0.00516795865633075 Mesoscale 0.013953488372093023 Morphology 0.01757105943152455 ONETEP 0.0036175710594315244 Polymorph 0.0010335917312661498 QMERA 0.0 QSAR 5.167958656330749E-4 Quantum Mechanics 0.6439276485788114 Reflex 0.04237726098191214 Reflex Plus 0.0020671834625322996 Semi-empirical 0.008268733850129198 Sorption 0.02945736434108527 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.004134366925064599 Visualization 1.0 X-Cell 5.167958656330749E-4 ZDOCK 0.034108527131782945

Year

2021 0.0

Keywords

target 1.0 visualization 0.26912303382891617 docking 0.2277526395173454 potential 0.19263089851325146 between 0.15147597500538676 analysis 0.14544279250161604 novel 0.09394527041585865 binding 0.08230984701572937 activity 0.07088989441930618 interaction 0.056022408963585436 energy 0.04287868993751347 protein 0.04244774833010127 experimental 0.04093945270415859 well 0.040293040293040296 synthesized 0.02865761689291101 synthesis 0.021116138763197588 drug 0.01874595992243051 compound 0.01680672268907563 cell 0.015513897866839044 mechanism 0.014867485455720749 chemical 0.014221073044602456 promising 0.005171299288946348 inhibition 0.003878474466709761 development 0.0028011204481792717 higher 0.0
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